Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 3/20 | 0.59 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.56 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.56 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.56 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.56 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.47 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.47 |
| ▸ | CDK2 | P24941 | 3/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.42 |
| ▸ | CDK9 | P50750 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 2/20 | 0.42 |
| ▸ | MYLK4 | Q86YV6 | 3/20 | 0.42 |
| ▸ | STK17A | Q9UEE5 | 3/20 | 0.42 |
| ▸ | DKK1 | O94907 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4033705 | 0.88 | PIM1 (0.67) | PIM1PIK3CAPIK3CDPIK3R1PIK3CB | |
| SCHEMBL4025570 | 0.84 | PIM1 (0.63) | PIM1PIK3CAPIK3CDPIK3R1PIK3CB | |
| SCHEMBL13908915 | 0.82 | JAK2 (0.57) | PIK3CAPIK3CDPIK3R1PIK3CBCDK2 | |
| SCHEMBL14499936 | 0.82 | PIK3CA (0.53) | PIM1PIK3CAPIK3CDPIK3R1PIK3CB | |
| SCHEMBL14499966 | 0.82 | PIK3CA (0.49) | PIM1PIK3CAPIK3CDPIK3R1PIK3CB | |
| SCHEMBL4027259 | 0.79 | PIM1 (0.67) | PIM1CDK2CDK1MYLK4STK17A | |
| SCHEMBL14499963 | 0.78 | ALDH1A1 (0.48) | PIK3CAPIK3CDPIK3R1PIK3CBCDK2 | |
| SCHEMBL13811881 | 0.78 | PIM1 (0.65) | PIM1CDK2CDK1STK17AMAPT | |
| SCHEMBL14499905 | 0.76 | PIM1 (0.69) | PIM1CDK2CCNT1CCNA2CDK9 | |
| SCHEMBL13811985 | 0.75 | PIM1 (0.60) | PIM1CDK2CDK1CDC7ROCK2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1581526-B1 | BENZISOXAZOLE DERIVATIVES USEFUL AS INHIBITORS OF PROTEIN KINASES | VERTEX PHARMA (US) | 2009-03-11 | — | — | EP | disclosed |
| US-7226919-B2 | Compositions useful as inhibitors of protein kinases | VERTEX PHARMACEUTICALS INC. (US) | 2007-06-05 | — | — | US | disclosed |
| US-7226919-B2 | Compositions useful as inhibitors of protein kinases | VERTEX PHARMACEUTICALS INC. (US) | 2007-06-05 | — | — | US | disclosed |