Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 4/20 | 0.57 |
| ▸ | CHEK1 | O14757 | 12/20 | 0.55 |
| ▸ | CDK1 | P06493 | 1/20 | 0.54 |
| ▸ | CDK2 | P24941 | 1/20 | 0.54 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL7000883 | 0.90 | KDR (0.55) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL7169051 | 0.89 | KDR (0.54) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL7096519 | 0.85 | CHEK1 (0.64) | KDRCHEK1CDK1CDK2 | |
| SCHEMBL6997411 | 0.85 | KDR (0.57) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL7092496 | 0.84 | KDR (0.56) | KDRCHEK1CDK1CDK2PDGFRB | |
| SCHEMBL7094319 | 0.83 | CHEK1 (0.66) | KDRCHEK1CDK1CDK2 | |
| SCHEMBL7700755 | 0.82 | CHEK1 (0.52) | KDRCHEK1CDK1CDK2 | |
| SCHEMBL7701117 | 0.82 | CHEK1 (0.51) | KDRCHEK1CDK1CDK2 | |
| SCHEMBL7701582 | 0.81 | KDR (0.70) | KDRCHEK1CDK1CDK2 | |
| SCHEMBL7701942 | 0.80 | CHEK1 (0.54) | KDRCHEK1CDK1CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |