Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 11/20 | 0.61 |
| ▸ | KDR | P35968 | 5/20 | 0.61 |
| ▸ | CDK1 | P06493 | 1/20 | 0.57 |
| ▸ | CDK2 | P24941 | 1/20 | 0.57 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7088696 | 0.88 | KDR (0.57) | CHEK1KDRCDK1CDK2PDGFRB | |
| SCHEMBL7089647 | 0.83 | KDR (0.67) | CHEK1KDRCDK1CDK2PDGFRB | |
| SCHEMBL6997102 | 0.82 | KDR (0.68) | CHEK1KDRCDK1CDK2NPC1 | |
| SCHEMBL6995193 | 0.80 | KDR (0.55) | CHEK1KDRCDK1CDK2PDGFRB | |
| SCHEMBL6970245 | 0.79 | KDR (0.72) | CHEK1KDRCDK1CDK2PDGFRB | |
| SCHEMBL7702752 | 0.79 | CHEK1 (0.64) | CHEK1KDRCDK1CDK2PDGFRB | |
| SCHEMBL7002588 | 0.78 | KDR (0.74) | CHEK1KDRCDK1CDK2PDGFRB | |
| SCHEMBL7000821 | 0.78 | KDR (0.62) | CHEK1KDRCDK1CDK2PDGFRB | |
| SCHEMBL7000053 | 0.78 | CHEK1 (0.97) | CHEK1KDRCDK1CDK2 | |
| SCHEMBL7002715 | 0.78 | KDR (0.78) | CHEK1KDRCDK1CDK2PDGFRB |
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 |