Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 11/20 | 0.48 |
| ▸ | KDR | P35968 | 4/20 | 0.43 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7090324 | 0.95 | CHEK1 (0.51) | CHEK1KDRCDK1CDK2KIT | |
| SCHEMBL7092229 | 0.94 | CHEK1 (0.49) | CHEK1KDRATG4BCDK1CDK2 | |
| SCHEMBL7001874 | 0.91 | CHEK1 (0.56) | CHEK1KDRCDK1CDK2APP | |
| SCHEMBL7093639 | 0.89 | CHEK1 (0.52) | CHEK1KDRATG4BCDK1CDK2 | |
| SCHEMBL7704080 | 0.88 | CHEK1 (0.48) | CHEK1KDRCDK1CDK2KIT | |
| SCHEMBL7092096 | 0.87 | CHEK1 (0.63) | CHEK1KDRCDK1CDK2KIT | |
| SCHEMBL7089380 | 0.87 | CHEK1 (0.56) | CHEK1KDRCDK1CDK2THRB | |
| SCHEMBL7094716 | 0.85 | CHEK1 (0.51) | CHEK1KDRCDK1CDK2KIT | |
| SCHEMBL7003703 | 0.84 | KDR (0.55) | CHEK1KDRDRD2DRD4DRD3 | |
| SCHEMBL7698800 | 0.82 | CHEK1 (0.55) | CHEK1KDRDRD2DRD4DRD3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1127051-A2 | TRICYCLIC PYRAZOLE DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 2001-08-29 | — | — | EP | claimed |
| WO-2000027822-A2 | TRICYCLIC PYRAZOLE DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 2000-05-18 | — | — | WO | claimed |
| US-6462036-B1 | INHIBITING SIGNAL TRANSDUCTION BY MODULATING ACTIVITY OF RECEPTOR AND NONRECEPTOR TYROSINE AND SERINE/THREONINE KINASES TO REGULATE AND MODULATE ABNORMAL OR INAPPROPRIATE CELL PROLIFERATION, DIFFERENTIATION, OR METABOLISM | BASF AKTIENGESELLSCHAFT (DE) | 2002-10-08 | — | — | US | disclosed |
| EP-1127051-A2 | TRICYCLIC PYRAZOLE DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000027822-A2 | TRICYCLIC PYRAZOLE DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 2000-05-18 | — | — | WO | disclosed |