2XYN - chain C (model B) | ABL proto-oncogene 2, non-receptor tyrosine kinase
Structure information
PDB: | 2XYN |
PubMed: | 21417343 |
Release date: | 2010-12-01 |
Resolution: | 2.81 Å |
Kinase: | ABL2 |
Family: | Abl |
Group: | TK |
Species: | HUMAN |
Quality Score: | 8 |
Missing Residues: | 0 |
Missing Atoms: | 78 |
DFG conformation: | in |
αC-helix conformation: | in |
Salt bridge KIII.17 and EαC.24: | No |
ASP rotation (xDFG.81) : | 340° |
PHE rotation (xDFG.82) : | 359° |
Activation loop position: | -3.3Å |
αC-helix position: | 17.4Å |
G-rich loop angle: | 58.8° |
G-rich loop distance: | 17.8Å |
G-rich loop rotation: | 6.5° |
Other models from this PDB:
2D & 3D views
Binding pocket waters
No waters were found in the defined clusters
Binding pocket sequence
Uniprot | HKLGGGQYGEVYVVAVKTLEFLKEAAVMKEIKPNLVQLLGVYIVTEYMPYGNLLDYLREYLEKKNFIHRDLAARNCLVVADFGLS |
Structure: | HKLGGGQYGEVYVVAVKTLEFLKEAAVMKEIKPNLVQLLGVYIVTEYMPYGNLLDYLREYLEKKNFIHRDLAARNCLVVADFGLS |
Modified residues
No modified residues identified.
Orthosteric ligand
Ligand HET-code: VX6
Ligand Name: CYCLOPROPANECARBOXYLIC ACID {4-[4-(4-METHYL-PIPERAZIN-1-YL)-6-(5-METHYL-2H-PYRAZOL-3-YLAMINO)-PYRIMIDIN-2-YLSULFANYL]-PHENYL}-AMIDE
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- LABELS
- KLIFS residue #
- Amino Acid
- None
- COLORS
- Interaction types
- KLIFS (all res.)
- KLIFS (interacting res.)
- None
- OTHER
- Show/hide non-interacting res.
- En/disable resizing interacting res.
This ligand targets the following (sub)pockets:
Main pockets | |
---|---|
Front | |
Gate | |
Back |
Subpockets | |
---|---|
FP-I | |
FP-II | |
BP-I-A | |
BP-I-B | |
BP-II-in | |
BP-II-A-in | |
BP-II-B-in | |
BP-II-out | |
BP-II-B | |
BP-III | |
BP-IV | |
BP-V |
Kinase-ligand interactions
■ Hydrophobic ♦ Aromatic face-to-face ♦ Aromatic face-to-edge ▲ H-bond donor ▲ H-bond acceptor ● Ionic positive ● Ionic negative
I | g.l | II | III | αC | |||||||||||||||
1 H 292 | 2 K 293 | 3 L 294 | 4 G 295 | 5 G 296 | 6 G 297 | 7 Q 298 | 8 Y 299 | 9 G 300 | 10 E 301 | 11 V 302 | 12 Y 303 | 13 V 304 | 14 V 314 | 15 A 315 | 16 V 316 | 17 K 317 | 18 T 318 | 19 L 319 | 20 E 328 |
■ | ■ | ■♦ | ■ | ■ | ■ | ||||||||||||||
αC | b.l | IV | |||||||||||||||||
21 F 329 | 22 L 330 | 23 K 331 | 24 E 332 | 25 A 333 | 26 A 334 | 27 V 335 | 28 M 336 | 29 K 337 | 30 E 338 | 31 I 339 | 32 K 340 | 33 P 342 | 34 N 343 | 35 L 344 | 36 V 345 | 37 Q 346 | 38 L 347 | 39 L 348 | 40 G 349 |
■ | |||||||||||||||||||
IV | V | GK | hinge | linker | αD | αE | |||||||||||||
41 V 350 | 42 Y 358 | 43 I 359 | 44 V 360 | 45 T 361 | 46 E 362 | 47 Y 363 | 48 M 364 | 49 P 365 | 50 Y 366 | 51 G 367 | 52 N 368 | 53 L 369 | 54 L 370 | 55 D 371 | 56 Y 372 | 57 L 373 | 58 R 374 | 59 E 375 | 60 Y 399 |
■ | ■ | ■ | ■▲ | ■ | ■ | ■ | |||||||||||||
αE | VI | c.l | VII | VIII | x | ||||||||||||||
61 L 400 | 62 E 401 | 63 K 402 | 64 K 403 | 65 N 404 | 66 F 405 | 67 I 406 | 68 H 407 | 69 R 408 | 70 D 409 | 71 L 410 | 72 A 411 | 73 A 412 | 74 R 413 | 75 N 414 | 76 C 415 | 77 L 416 | 78 V 417 | 79 V 425 | 80 A 426 |
■ | |||||||||||||||||||
DFG | a.l | ||||||||||||||||||
81 D 427 | 82 F 428 | 83 G 429 | 84 L 430 | 85 S 431 | |||||||||||||||
■▲ |
Binding affinities
ChEMBL ID:CHEMBL572878Bioaffinities: 616 records for 214 kinase(s)
Species | Kinase (ChEMBL naming) | Median | Min | Max | Type | Records |
---|---|---|---|---|---|---|
Homo sapiens | 3-phosphoinositide dependent protein kinase-1 | 5.6 | 5.6 | 5.6 | pKi | 1 |
Homo sapiens | Activin receptor type-1 | 5.7 | 5.7 | 5.7 | pKd | 2 |
Homo sapiens | Activin receptor type-1 | 5.9 | 5.9 | 5.9 | pKi | 1 |
Homo sapiens | Adaptor-associated kinase | 6.5 | 6.5 | 6.5 | pKd | 3 |
Homo sapiens | ALK tyrosine kinase receptor | 5.5 | 5.5 | 5.5 | pKd | 2 |
Homo sapiens | ALK tyrosine kinase receptor | 5.6 | 5.6 | 5.6 | pKi | 1 |
Homo sapiens | AMP-activated protein kinase, alpha-1 subunit | 6 | 6 | 6 | pKd | 2 |
Homo sapiens | AMP-activated protein kinase, alpha-1 subunit | 5.6 | 5.6 | 5.6 | pKi | 1 |
Homo sapiens | AMP-activated protein kinase, alpha-2 subunit | 6.5 | 6.5 | 6.5 | pKd | 2 |
Homo sapiens | Ankyrin repeat and protein kinase domain-containing protein 1 | 5.3 | 5.3 | 5.3 | pKd | 2 |
Xenopus laevis | Aurora kinase B-A | 7.7 | 7.7 | 7.7 | pIC50 | 1 |
Homo sapiens | BMP-2-inducible protein kinase | 7.2 | 6.4 | 7.2 | pKd | 3 |
Homo sapiens | Bone morphogenetic protein receptor type-1B | 6 | 6 | 6 | pKd | 1 |
Homo sapiens | Bone morphogenetic protein receptor type-2 | 5.2 | 5.2 | 5.2 | pKd | 2 |
Homo sapiens | Breakpoint cluster region protein | 6.3 | 6.3 | 6.3 | pKd | 2 |
Homo sapiens | BR serine/threonine-protein kinase 1 | 5.1 | 5.1 | 5.1 | pKd | 1 |
Homo sapiens | BR serine/threonine-protein kinase 1 | 5.2 | 5.2 | 5.2 | pKi | 1 |
Homo sapiens | CaM kinase I alpha | 5.2 | 5.2 | 5.2 | pKd | 1 |
Homo sapiens | CaM kinase I delta | 5.3 | 5.3 | 5.3 | pKd | 2 |
Homo sapiens | CaM kinase I gamma | 5.2 | 5.2 | 5.2 | pKd | 1 |
Homo sapiens | CaM-kinase kinase alpha | 5.3 | 5.3 | 5.3 | pKd | 1 |
Homo sapiens | Casein kinase II alpha | 6.4 | 6.4 | 6.4 | pKd | 1 |
Homo sapiens | Casein kinase II alpha (prime) | 6.4 | 6.4 | 6.4 | pKd | 1 |
Homo sapiens | Cell division cycle 2-like protein kinase 6 | 6.7 | 6.7 | 6.7 | pKi | 1 |
Homo sapiens | c-Jun N-terminal kinase 3 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | c-Jun N-terminal kinase 3 | 5.7 | 5.7 | 5.7 | pKi | 1 |
Homo sapiens | Cyclin-dependent kinase-like 2 | 7.3 | 7.3 | 7.3 | pKd | 1 |
Homo sapiens | Cyclin-dependent kinase-like 3 | 6.5 | 6.5 | 6.5 | pKd | 1 |
Homo sapiens | Cyclin-dependent kinase-like 5 | 5.6 | 5.6 | 5.6 | pKd | 1 |
Homo sapiens | Death-associated protein kinase 3 | 5 | 5 | 6.7 | pKd | 2 |
Homo sapiens | Discoidin domain-containing receptor 2 | 6.6 | 6.6 | 7.8 | pIC50 | 2 |
Homo sapiens | Discoidin domain-containing receptor 2 | 6.6 | 6.6 | 6.6 | pKd | 3 |
Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 1 | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 1 | 5.9 | 5.9 | 5.9 | pKi | 1 |
Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 2 | 5.7 | 5.7 | 5.7 | pKd | 2 |
Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 2 | 5.7 | 5.7 | 5.7 | pKi | 1 |
Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 5 | 6.6 | 6.6 | 6.6 | pKd | 1 |
Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 6 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Dual specificity protein kinase TTK | 5.1 | 5.1 | 5.1 | pKd | 1 |
Homo sapiens | Dual specificity testis-specific protein kinase 1 | 5.3 | 5.3 | 5.3 | pKd | 2 |
Homo sapiens | Ephrin type-A receptor 1 | 6 | 6 | 6 | pKd | 2 |
Homo sapiens | Ephrin type-A receptor 2 | 6.1 | 6.1 | 6.1 | pKd | 2 |
Homo sapiens | Ephrin type-A receptor 2 | 6.2 | 6.2 | 6.2 | pKi | 1 |
Homo sapiens | Ephrin type-A receptor 3 | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Ephrin type-A receptor 4 | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Ephrin type-A receptor 6 | 5.3 | 5.3 | 5.3 | pKd | 1 |
Homo sapiens | Ephrin type-A receptor 8 | 6.3 | 6.3 | 6.3 | pKd | 2 |
Homo sapiens | Ephrin type-B receptor 1 | 5.7 | 5.7 | 5.7 | pKd | 2 |
Homo sapiens | Ephrin type-B receptor 2 | 5.3 | 5.3 | 5.3 | pKd | 1 |
Homo sapiens | Ephrin type-B receptor 4 | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Ephrin type-B receptor 6 | 7.6 | 7.6 | 7.6 | pKd | 1 |
Homo sapiens | Epidermal growth factor receptor erbB1 | 5.8 | 5.8 | 5.8 | pKi | 1 |
Homo sapiens | Epithelial discoidin domain-containing receptor 1 | 7.6 | 7.6 | 7.6 | pKd | 2 |
Homo sapiens | Eukaryotic translation initiation factor 2-alpha kinase 4 | 5.7 | 5.7 | 5.7 | pKd | 2 |
Homo sapiens | Fibroblast growth factor receptor 1 | 6.3 | 6.3 | 6.3 | pKd | 2 |
Homo sapiens | Fibroblast growth factor receptor 1 | 6.1 | 6.1 | 6.1 | pKi | 1 |
Homo sapiens | Fibroblast growth factor receptor 2 | 6.2 | 6.2 | 6.2 | pKd | 2 |
Homo sapiens | Fibroblast growth factor receptor 3 | 6.1 | 6.1 | 6.1 | pKd | 4 |
Homo sapiens | Fibroblast growth factor receptor 3 | 6.2 | 6.2 | 6.2 | pKi | 1 |
Homo sapiens | Fibroblast growth factor receptor 4 | 5.1 | 5.1 | 5.1 | pKd | 2 |
Homo sapiens | G protein-coupled receptor kinase 4 | 6.4 | 6.4 | 6.4 | pKd | 1 |
Homo sapiens | Hepatocyte growth factor receptor | 6.2 | 6 | 6.4 | pKd | 5 |
Homo sapiens | Hormonally up-regulated neu tumor-associated kinase | 5 | 5 | 5 | pKd | 1 |
Homo sapiens | Inhibitor of nuclear factor kappa B kinase epsilon subunit | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Insulin-like growth factor I receptor | 6.3 | 6.3 | 6.3 | pIC50 | 1 |
Homo sapiens | Insulin-like growth factor I receptor | 6.1 | 6.1 | 6.1 | pKd | 2 |
Homo sapiens | Insulin receptor | 6.2 | 6.2 | 6.3 | pKd | 3 |
Homo sapiens | Insulin receptor | 6 | 6 | 6 | pKi | 1 |
Homo sapiens | Insulin receptor-related protein | 6.5 | 6.5 | 6.6 | pKd | 3 |
Homo sapiens | Interleukin-1 receptor-associated kinase 3 | 5.3 | 5.3 | 5.3 | pKd | 1 |
Homo sapiens | Interleukin-1 receptor-associated kinase 4 | 5.4 | 5.4 | 5.4 | pKd | 1 |
Homo sapiens | Interleukin-1 receptor-associated kinase 4 | 5.6 | 5.6 | 5.6 | pKi | 1 |
Homo sapiens | Leucine-rich repeat serine/threonine-protein kinase 2 | 6.2 | 6.2 | 6.2 | pKi | 1 |
Homo sapiens | Leukocyte tyrosine kinase receptor | 5.1 | 5.1 | 5.1 | pKd | 2 |
Homo sapiens | Leukocyte tyrosine kinase receptor | 6.3 | 6.3 | 6.3 | pKi | 1 |
Homo sapiens | LIM domain kinase 1 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | LIM domain kinase 1 | 6.1 | 6.1 | 6.1 | pKi | 1 |
Homo sapiens | LIM domain kinase 2 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Macrophage colony stimulating factor receptor | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Macrophage-stimulating protein receptor | 5.9 | 5.9 | 5.9 | pKd | 1 |
Homo sapiens | Macrophage-stimulating protein receptor | 6.1 | 6.1 | 6.1 | pKi | 1 |
Homo sapiens | MAP kinase-activated protein kinase 2 | 5.4 | 5.4 | 5.4 | pKd | 1 |
Homo sapiens | MAP kinase signal-integrating kinase 2 | 5.3 | 5.3 | 5.3 | pKd | 1 |
Homo sapiens | MAP/microtubule affinity-regulating kinase 2 | 5.9 | 5.9 | 5.9 | pKd | 2 |
Homo sapiens | MAP/microtubule affinity-regulating kinase 2 | 6 | 6 | 6 | pKi | 1 |
Homo sapiens | MAP/microtubule affinity-regulating kinase 4 | 5.3 | 5.3 | 5.3 | pKd | 2 |
Homo sapiens | MAP/microtubule affinity-regulating kinase 4 | 6 | 6 | 6 | pKi | 1 |
Homo sapiens | Maternal embryonic leucine zipper kinase | 6.4 | 6.4 | 6.4 | pIC50 | 1 |
Homo sapiens | Maternal embryonic leucine zipper kinase | 6.6 | 6.6 | 6.6 | pKd | 2 |
Homo sapiens | Maternal embryonic leucine zipper kinase | 7.4 | 7.4 | 7.4 | pKi | 1 |
Homo sapiens | Misshapen-like kinase 1 | 5.7 | 5.7 | 6 | pKd | 2 |
Homo sapiens | Misshapen-like kinase 1 | 5.2 | 5.2 | 5.2 | pKi | 1 |
Homo sapiens | Mitogen-activated protein kinase 7 | 5.2 | 5.2 | 5.2 | pKd | 1 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 10 | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 10 | 6.4 | 6.4 | 6.4 | pKi | 1 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 11 | 6.2 | 6.2 | 6.2 | pKd | 3 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 12 | 6.7 | 6.7 | 6.7 | pKd | 1 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 13 | 6.8 | 6.8 | 6.8 | pKd | 1 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 2 | 6 | 6 | 6 | pKd | 1 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 3 | 5.7 | 5.7 | 5.7 | pKd | 1 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 4 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 7 | 5.6 | 5.6 | 5.6 | pKd | 1 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase 9 | 6.4 | 6.4 | 6.4 | pKd | 2 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 1 | 7.1 | 7.1 | 7.1 | pKd | 2 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 2 | 5.6 | 5.6 | 5.6 | pKd | 1 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 3 | 6.5 | 6.5 | 6.5 | pKd | 2 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 4 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 5 | 7.1 | 5.8 | 7.3 | pKd | 4 |
Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 5 | 6.8 | 6.8 | 6.8 | pKi | 1 |
Homo sapiens | Mixed lineage kinase 7 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Mixed lineage kinase 7 | 5.1 | 5.1 | 5.1 | pKi | 1 |
Homo sapiens | Muscle, skeletal receptor tyrosine protein kinase | 6.5 | 6.5 | 6.5 | pKd | 2 |
Homo sapiens | Myosin light chain kinase | 7.8 | 7.8 | 7.8 | pKd | 2 |
Homo sapiens | myosin light chain kinase 2 | 7.4 | 7.4 | 7.4 | pKd | 2 |
Homo sapiens | Myosin light chain kinase family member 4 | 5.7 | 5.7 | 5.7 | pKd | 2 |
Gallus gallus | Myosin light chain kinase, smooth muscle | 7.8 | 7.8 | 7.8 | pKd | 1 |
Homo sapiens | Nerve growth factor receptor Trk-A | 7.4 | 7.4 | 8.5 | pKd | 4 |
Homo sapiens | Nerve growth factor receptor Trk-A | 6.5 | 6.5 | 6.5 | pKi | 1 |
Homo sapiens | Neurotrophic tyrosine kinase receptor type 2 | 6.6 | 6.6 | 6.6 | pKd | 2 |
Homo sapiens | Neurotrophic tyrosine kinase receptor type 2 | 6.5 | 6.5 | 6.5 | pKi | 1 |
Homo sapiens | Non-receptor tyrosine-protein kinase TNK1 | 7.1 | 7.1 | 7.1 | pKd | 3 |
Homo sapiens | NT-3 growth factor receptor | 6.7 | 6.7 | 6.7 | pKd | 2 |
Homo sapiens | NT-3 growth factor receptor | 6.2 | 6.2 | 6.2 | pKi | 1 |
Homo sapiens | NUAK family SNF1-like kinase 1 | 6.7 | 6.7 | 6.7 | pKd | 2 |
Homo sapiens | NUAK family SNF1-like kinase 2 | 6.3 | 6.3 | 6.3 | pKd | 2 |
Homo sapiens | Phosphatidylinositol-4-phosphate 5-kinase type-1 alpha | 6.9 | 6.9 | 6.9 | pKd | 2 |
Homo sapiens | Phosphatidylinositol-5-phosphate 4-kinase type-2 beta | 6.9 | 6.9 | 6.9 | pKd | 2 |
Homo sapiens | Phosphorylase kinase gamma subunit 1 | 5.7 | 5.7 | 5.7 | pKd | 2 |
Homo sapiens | Phosphorylase kinase gamma subunit 2 | 5.4 | 5.4 | 5.4 | pKd | 1 |
Homo sapiens | PITSLRE serine/threonine-protein kinase CDC2L1 | 6.5 | 6.5 | 6.5 | pKd | 2 |
Homo sapiens | PITSLRE serine/threonine-protein kinase CDC2L2 | 6.6 | 6.6 | 6.6 | pKd | 2 |
Homo sapiens | Platelet-derived growth factor receptor alpha | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Platelet-derived growth factor receptor beta | 6.5 | 6.5 | 6.5 | pKd | 2 |
Homo sapiens | Platelet-derived growth factor receptor beta | 6.4 | 6.4 | 6.4 | pKi | 1 |
Homo sapiens | Protein kinase C theta | 5.3 | 5.3 | 5.3 | pKd | 1 |
Homo sapiens | Protein kinase C zeta | 5.1 | 5.1 | 5.1 | pKi | 1 |
Homo sapiens | Protein kinase N1 | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Protein kinase N2 | 5.3 | 5.3 | 5.3 | pKd | 1 |
Homo sapiens | Protein kinase N2 | 5.3 | 5.3 | 5.3 | pKi | 1 |
Homo sapiens | Protein tyrosine kinase 2 beta | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Proto-oncogene tyrosine-protein kinase MER | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Proto-oncogene tyrosine-protein kinase ROS | 6.2 | 6.2 | 6.2 | pKd | 2 |
Homo sapiens | Proto-oncogene tyrosine-protein kinase ROS | 6.8 | 6.8 | 6.8 | pKi | 1 |
Homo sapiens | Putative uncharacterized serine/threonine-protein kinase SgK110 | 6.3 | 6.3 | 6.3 | pKd | 1 |
Homo sapiens | Receptor-interacting serine/threonine-protein kinase 1 | 6.7 | 6.7 | 6.7 | pIC50 | 1 |
Homo sapiens | Receptor-interacting serine/threonine-protein kinase 1 | 7.7 | 7.7 | 7.7 | pKd | 3 |
Mus musculus | Receptor-interacting serine/threonine-protein kinase 1 | 6 | 6 | 6 | pIC50 | 2 |
Homo sapiens | Receptor-interacting serine/threonine-protein kinase 4 | 6.5 | 6.5 | 6.5 | pKd | 1 |
Homo sapiens | Receptor tyrosine-protein kinase erbB-3 | 5.2 | 5.2 | 5.2 | pKd | 1 |
Homo sapiens | Ribosomal protein S6 kinase 1 | 5.5 | 5.5 | 5.5 | pKi | 1 |
Homo sapiens | Ribosomal protein S6 kinase alpha 1 | 5.1 | 5.1 | 5.1 | pKd | 2 |
Homo sapiens | Ribosomal protein S6 kinase alpha 2 | 5.7 | 5.7 | 5.7 | pKd | 4 |
Homo sapiens | Ribosomal protein S6 kinase alpha 3 | 5.2 | 5.2 | 5.2 | pKd | 4 |
Homo sapiens | Serine/threonine-protein kinase 10 | 6.9 | 6.9 | 6.9 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase 11 | 5.9 | 5.9 | 5.9 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase 16 | 6.2 | 6.2 | 6.2 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase 17A | 5.1 | 5.1 | 5.1 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase 2 | 7.1 | 7.1 | 7.1 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase 2 | 6.3 | 6.3 | 6.3 | pKi | 1 |
Homo sapiens | Serine/threonine-protein kinase 24 | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase 25 | 5.3 | 5.3 | 5.3 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase 38-like | 5.2 | 5.2 | 5.2 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase Aurora-A | 8.2 | 6.5 | 9.6 | pIC50 | 27 |
Homo sapiens | Serine/threonine-protein kinase Aurora-A | 8.8 | 7.8 | 9.5 | pKd | 11 |
Homo sapiens | Serine/threonine-protein kinase Aurora-A | 9.2 | 8.5 | 9.4 | pKi | 16 |
Homo sapiens | Serine/threonine-protein kinase Aurora-B | 7.5 | 6.1 | 7.8 | pIC50 | 20 |
Homo sapiens | Serine/threonine-protein kinase Aurora-B | 8.1 | 7 | 8.2 | pKd | 4 |
Homo sapiens | Serine/threonine-protein kinase Aurora-B | 7.8 | 7.8 | 8.7 | pKi | 15 |
Homo sapiens | Serine/threonine-protein kinase Aurora-C | 8.3 | 7.2 | 8.3 | pIC50 | 3 |
Homo sapiens | Serine/threonine-protein kinase Aurora-C | 8.2 | 8.2 | 8.2 | pKd | 3 |
Homo sapiens | Serine/threonine-protein kinase Aurora-C | 8.3 | 8.3 | 8.3 | pKi | 12 |
Homo sapiens | Serine/threonine-protein kinase Chk1 | 5.1 | 5.1 | 5.1 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase c-TAK1 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase c-TAK1 | 5.4 | 5.4 | 5.4 | pKi | 1 |
Homo sapiens | Serine/threonine-protein kinase D2 | 5.3 | 5.3 | 5.3 | pKi | 1 |
Homo sapiens | Serine/threonine-protein kinase DCLK3 | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase/endoribonuclease IRE1 | 5.3 | 5.3 | 5.3 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase GAK | 5.5 | 5.5 | 5.5 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase LATS1 | 5.3 | 5.3 | 5.3 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase LATS2 | 5.2 | 5.2 | 5.2 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase MARK1 | 5.3 | 5.3 | 5.3 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase MST1 | 6.7 | 6.7 | 6.7 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase MST2 | 6.3 | 6.3 | 6.3 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase MST4 | 5.5 | 5.5 | 5.5 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase Nek5 | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase NEK7 | 5.1 | 5.1 | 5.1 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase PAK 1 | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase PAK 1 | 5.1 | 5.1 | 5.1 | pKi | 1 |
Homo sapiens | Serine/threonine-protein kinase PAK 2 | 5.2 | 5.2 | 5.2 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase PAK 3 | 5.5 | 5.5 | 5.5 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase PAK 4 | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase PAK 4 | 5.4 | 5.4 | 5.4 | pKi | 1 |
Homo sapiens | Serine/threonine-protein kinase PAK6 | 5 | 5 | 5 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase PAK7 | 5.5 | 5.5 | 5.5 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase PCTAIRE-1 | 6.6 | 6.6 | 6.6 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase PCTAIRE-2 | 5.3 | 5.3 | 5.3 | pKd | 1 |
Mycobacterium tuberculosis | Serine/threonine-protein kinase pknB | 5.7 | 5.7 | 5.7 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase PLK4 | 8 | 6.3 | 8.1 | pKd | 4 |
Homo sapiens | Serine/threonine-protein kinase PLK4 | 8 | 7.6 | 8 | pKi | 3 |
Homo sapiens | Serine/threonine-protein kinase PRP4 homolog | 5.6 | 5.6 | 5.6 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase receptor R3 | 5 | 5 | 5 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase RIO1 | 6.4 | 6.4 | 6.4 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase RIO2 | 6.6 | 6.6 | 6.6 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase RIO3 | 6.2 | 6.2 | 6.2 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase SIK1 | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase SIK2 | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase SIK2 | 6 | 6 | 6 | pKi | 1 |
Homo sapiens | Serine/threonine-protein kinase SRPK1 | 7.1 | 7.1 | 7.1 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase SRPK2 | 6.2 | 6.2 | 6.2 | pKd | 2 |
Homo sapiens | Serine/threonine-protein kinase SRPK3 | 6.6 | 6.6 | 6.6 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase TAO1 | 6.5 | 6.5 | 6.5 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase TAO1 | 7.1 | 7.1 | 7.1 | pKi | 1 |
Homo sapiens | Serine/threonine-protein kinase TAO2 | 6.4 | 6.4 | 6.4 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase TAO3 | 7.1 | 7.1 | 7.1 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase TBK1 | 8.2 | 8.2 | 8.2 | pIC50 | 1 |
Homo sapiens | Serine/threonine-protein kinase TBK1 | 6.3 | 6.3 | 6.3 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase tousled-like 1 | 5.4 | 5.4 | 5.4 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase ULK3 | 6.5 | 6.5 | 6.5 | pKd | 1 |
Homo sapiens | Serine/threonine-protein kinase WEE1 | 5.5 | 5.5 | 5.5 | pKd | 2 |
Homo sapiens | SPS1/STE20-related protein kinase YSK4 | 7.3 | 7.3 | 7.3 | pKd | 1 |
Homo sapiens | Stem cell growth factor receptor | 6.5 | 5.6 | 6.6 | pKd | 15 |
Homo sapiens | TGF-beta receptor type I | 5.1 | 5.1 | 5.1 | pKd | 1 |
Homo sapiens | TRAF2- and NCK-interacting kinase | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Tyrosine kinase non-receptor protein 2 | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase ABL | 8 | 5.1 | 8.5 | pKd | 23 |
Homo sapiens | Tyrosine-protein kinase ABL | 7.5 | 7.4 | 7.8 | pKi | 3 |
Mus musculus | Tyrosine-protein kinase ABL | 5.3 | 5.3 | 5.3 | pIC50 | 1 |
Homo sapiens | Tyrosine-protein kinase ABL2 | 8.4 | 6.5 | 8.4 | pKd | 4 |
Homo sapiens | Tyrosine-protein kinase BLK | 5.7 | 5.7 | 5.7 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase BLK | 7.5 | 7.5 | 7.5 | pKi | 1 |
Homo sapiens | Tyrosine-protein kinase BMX | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase BTK | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase BTK | 5.8 | 5.8 | 5.8 | pKi | 1 |
Homo sapiens | Tyrosine-protein kinase CSK | 5.3 | 5.3 | 5.3 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase FER | 5.4 | 5.4 | 5.4 | pKd | 1 |
Homo sapiens | Tyrosine-protein kinase FES | 5.1 | 5.1 | 5.1 | pKd | 1 |
Homo sapiens | Tyrosine-protein kinase FGR | 6.1 | 6.1 | 6.1 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase FRK | 5.4 | 5.4 | 5.4 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase FYN | 6.3 | 6.3 | 6.3 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase FYN | 5.5 | 5.5 | 5.5 | pKi | 1 |
Homo sapiens | Tyrosine-protein kinase HCK | 5.2 | 5.2 | 5.2 | pKd | 1 |
Homo sapiens | Tyrosine-protein kinase ITK/TSK | 6.5 | 6.5 | 6.5 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase ITK/TSK | 7.2 | 7.2 | 7.2 | pKi | 1 |
Homo sapiens | Tyrosine-protein kinase JAK1 | 5.2 | 5.2 | 5.2 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase JAK2 | 6.7 | 6.7 | 6.7 | pKd | 6 |
Homo sapiens | Tyrosine-protein kinase JAK2 | 6.6 | 6.6 | 6.6 | pKi | 2 |
Homo sapiens | Tyrosine-protein kinase JAK3 | 6.2 | 6.2 | 6.2 | pKd | 4 |
Homo sapiens | Tyrosine-protein kinase LCK | 7.2 | 7.2 | 7.2 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase LCK | 6.9 | 6.9 | 7.1 | pKi | 2 |
Homo sapiens | Tyrosine-protein kinase Lyn | 6.2 | 6.2 | 6.2 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase Lyn | 6.6 | 6.6 | 6.6 | pKi | 1 |
Homo sapiens | Tyrosine-protein kinase receptor FLT3 | 7.5 | 7.5 | 7.5 | pIC50 | 1 |
Homo sapiens | Tyrosine-protein kinase receptor FLT3 | 7.9 | 6.3 | 8.4 | pKd | 17 |
Homo sapiens | Tyrosine-protein kinase receptor FLT3 | 7.5 | 6.4 | 7.5 | pKi | 5 |
Homo sapiens | Tyrosine-protein kinase receptor RET | 7.6 | 6.4 | 8.1 | pKd | 8 |
Homo sapiens | Tyrosine-protein kinase receptor RET | 7.9 | 7.9 | 7.9 | pKi | 1 |
Homo sapiens | Tyrosine-protein kinase receptor Tie-1 | 6.6 | 6.6 | 6.6 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase receptor TYRO3 | 5.9 | 5.9 | 5.9 | pKi | 1 |
Homo sapiens | Tyrosine-protein kinase receptor UFO | 6.7 | 6.7 | 6.7 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase receptor UFO | 6.7 | 6.7 | 6.7 | pKi | 1 |
Gallus gallus | Tyrosine-protein kinase SRC | 6.5 | 6.5 | 6.5 | pIC50 | 1 |
Homo sapiens | Tyrosine-protein kinase SRC | 6.8 | 6.8 | 6.8 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase SRC | 6.8 | 6.8 | 6.8 | pKi | 1 |
Homo sapiens | Tyrosine-protein kinase SYK | 5.8 | 5.8 | 5.8 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase TEC | 5.1 | 5.1 | 5.1 | pKd | 1 |
Homo sapiens | Tyrosine-protein kinase TIE-2 | 6.4 | 6.4 | 6.4 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase TXK | 5.6 | 5.6 | 5.6 | pKd | 2 |
Homo sapiens | Tyrosine-protein kinase TYK2 | 5.2 | 5.2 | 6.3 | pKd | 4 |
Homo sapiens | Tyrosine-protein kinase TYK2 | 6.7 | 6.7 | 6.7 | pKi | 2 |
Homo sapiens | Tyrosine-protein kinase YES | 6.3 | 6.3 | 6.3 | pKd | 2 |
Homo sapiens | Vascular endothelial growth factor receptor 1 | 7 | 7 | 7 | pKd | 2 |
Homo sapiens | Vascular endothelial growth factor receptor 1 | 5.9 | 5.9 | 5.9 | pKi | 1 |
Homo sapiens | Vascular endothelial growth factor receptor 2 | 5.7 | 5.7 | 5.7 | pKd | 2 |
Homo sapiens | Vascular endothelial growth factor receptor 2 | 6.5 | 6.5 | 6.5 | pKi | 1 |
Homo sapiens | Vascular endothelial growth factor receptor 3 | 5.7 | 5.7 | 5.7 | pKd | 2 |
Homo sapiens | Vascular endothelial growth factor receptor 3 | 5.8 | 5.8 | 5.8 | pKi | 1 |
Homo sapiens | Wee1-like protein kinase 2 | 5.4 | 5.4 | 5.4 | pKd | 1 |
Allosteric ligand
Ligand HET-code: VX6
Ligand Name: CYCLOPROPANECARBOXYLIC ACID {4-[4-(4-METHYL-PIPERAZIN-1-YL)-6-(5-METHYL-2H-PYRAZOL-3-YLAMINO)-PYRIMIDIN-2-YLSULFANYL]-PHENYL}-AMIDE
Binding affinities
Ligand not found in ChEMBL.