Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 11/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.53 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6091120 | 1.00 | KDR (0.53) | KDRCHEK1PDGFRBFGFR1HDAC1 | |
| SCHEMBL6088181 | 0.90 | KDR (0.40) | KDRCHEK1PDGFRBFGFR1HDAC1 | |
| SCHEMBL6089170 | 0.88 | KDR (0.38) | KDRCHEK1PDGFRBFGFR1DRD4 | |
| SCHEMBL6090371 | 0.87 | KDR (0.38) | KDRCHEK1PDGFRBFGFR1HDAC1 | |
| SCHEMBL6088641 | 0.87 | KDR (0.38) | KDRCHEK1PDGFRBFGFR1DRD4 | |
| SCHEMBL7490849 | 0.87 | KDR (0.37) | KDRCHEK1PDGFRBFGFR1HDAC1 | |
| SCHEMBL6092632 | 0.86 | KDR (0.37) | KDRCHEK1PDGFRBFGFR1DRD4 | |
| SCHEMBL6088629 | 0.86 | KDR (0.66) | KDRCHEK1PDGFRBFGFR1HDAC1 | |
| SCHEMBL6092423 | 0.85 | KDR (0.36) | KDRCHEK1PDGFRBFGFR1DRD4 | |
| SCHEMBL6092427 | 0.85 | KDR (0.36) | KDRCHEK1PDGFRBFGFR1DRD4 |
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-1218373-A2 | 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2002-07-03 | — | — | EP | claimed |
| WO-2001009121-A2 | 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-08 | — | — | WO | claimed |
| US-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |