Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 15/20 | 0.79 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.79 |
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.49 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.49 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | DDO | Q99489 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29370693 | 0.89 | KDR (1.00) | KDRCHEK1BRD4PDGFRBFGFR1 | |
| SCHEMBL5076094 | 0.89 | KDR (1.00) | KDRCHEK1BRD4PDGFRBFGFR1 | |
| SCHEMBL27488931 | 0.84 | KDR (0.77) | KDRCHEK1PDGFRBFGFR1DAO | |
| SCHEMBL5082453 | 0.84 | KDR (0.77) | KDRCHEK1BRD4PDGFRBFGFR1 | |
| SCHEMBL5076134 | 0.81 | KDR (0.72) | KDRCHEK1BRD4PDGFRBFGFR1 | |
| SCHEMBL5078673 | 0.80 | KDR (0.70) | KDRCHEK1DAODDOKDM4E | |
| SCHEMBL5208407 | 0.79 | KDR (0.74) | KDRCHEK1BRD4PDGFRBFGFR1 | |
| SCHEMBL5389152 | 0.79 | KDR (0.68) | KDRCHEK1PDGFRBFGFR1 | |
| SCHEMBL5082009 | 0.79 | KDR (0.68) | KDRCHEK1BRD4 | |
| SCHEMBL5207582 | 0.79 | KDR (0.73) | KDRCHEK1BRD4PDGFRBFGFR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1213045-C | Tyrosine kinase inhibitors | MERCK & CO INC (US) | 2005-08-03 | — | — | CN | disclosed |
| CN-1409708-A | Tyrosine kinase inhibitors | MERCK & CO INC (US) | 2003-04-09 | — | — | CN | disclosed |