Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 14/20 | 0.74 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | PKLR | P30613 | 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 | |
|---|---|---|---|---|
| SCHEMBL5357068 | 0.85 | KDR (0.88) | KDRCHEK1PKM | |
| SCHEMBL5367396 | 0.85 | KDR (1.00) | KDRCHEK1PKM | |
| SCHEMBL5367711 | 0.83 | KDR (0.70) | KDRCHEK1PKMCDK8 | |
| SCHEMBL5356295 | 0.78 | KDR (0.73) | KDRCHEK1PKM | |
| SCHEMBL5357658 | 0.76 | KDR (0.78) | KDRCHEK1PKM | |
| SCHEMBL14590416 | 0.74 | KDR (0.88) | KDRCHEK1PKM | |
| SCHEMBL5355012 | 0.74 | KDR (1.00) | KDRCHEK1PKM | |
| SCHEMBL5076094 | 0.74 | KDR (1.00) | KDRCHEK1 | |
| SCHEMBL29370693 | 0.74 | KDR (1.00) | KDRCHEK1 | |
| SCHEMBL5078767 | 0.73 | CHEK1 (0.73) | KDRCHEK1 |
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-7169788-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2007-01-30 | — | — | US | disclosed |
| US-7169788-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2007-01-30 | — | — | US | disclosed |
| US-7169788-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2007-01-30 | — | — | US | disclosed |