Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 12/20 | 0.60 |
| ▸ | CDK2 | P24941 | 9/20 | 0.60 |
| ▸ | MTOR | P42345 | 8/20 | 0.60 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.60 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.60 |
| ▸ | SMG1 | Q96Q15 | 7/20 | 0.60 |
| ▸ | IKBKB | O14920 | 3/20 | 0.58 |
| ▸ | DKK1 | O94907 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 1/20 | 0.54 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.53 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.53 |
| ▸ | CDK9 | P50750 | 5/20 | 0.53 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.53 |
| ▸ | CDK7 | P50613 | 3/20 | 0.53 |
| ▸ | CCNH | P51946 | 3/20 | 0.53 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.53 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.52 |
| ▸ | SYK | P43405 | 2/20 | 0.51 |
| ▸ | LYN | P07948 | 1/20 | 0.51 |
| ▸ | TXK | P42681 | 1/20 | 0.51 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14263719 | 0.89 | DKK1 (0.66) | MTORSMG1IKBKBDKK1GSK3B | |
| SCHEMBL3521890 | 0.85 | CDK1 (0.62) | CDK1CDK2MTORPIK3CAPIK3CG | |
| SCHEMBL14253983 | 0.84 | CDK1 (0.62) | CDK1CDK2MTORPIK3CAPIK3CG | |
| SCHEMBL14253976 | 0.84 | CDK1 (0.62) | CDK1CDK2MTORPIK3CAPIK3CG | |
| SCHEMBL14263685 | 0.82 | ROCK1 (0.52) | CDK1CDK2MTORPIK3CAPIK3CG | |
| SCHEMBL6752979 | 0.81 | CAMK2D (0.67) | CDK1CDK2MTORPIK3CAPIK3CG | |
| SCHEMBL7524252 | 0.80 | CDK1 (0.69) | CDK1CDK2MTORPIK3CAPIK3CG | |
| SCHEMBL6752978 | 0.80 | CDK1 (0.66) | CDK1CDK2MTORPIK3CAPIK3CG | |
| SCHEMBL3518683 | 0.80 | IKBKB (0.66) | CDK1CDK2MTORPIK3CAPIK3CG | |
| SCHEMBL7471938 | 0.79 | ABL1 (0.70) | CDK1CDK2MTORPIK3CAPIK3CG |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7348335-B2 | Compositions useful as inhibitors of JAK and other protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-03-25 | — | — | US | disclosed |