Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 8/20 | 0.63 |
| ▸ | CDK8 | P49336 | 3/20 | 0.60 |
| ▸ | KDR | P35968 | 7/20 | 0.60 |
| ▸ | BRAF | P15056 | 2/20 | 0.58 |
| ▸ | FLT1 | P17948 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | PLK4 | O00444 | 1/20 | 0.58 |
| ▸ | CIT | O14578 | 1/20 | 0.58 |
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
| ▸ | MUSK | O15146 | 1/20 | 0.58 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.58 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.58 |
| ▸ | MLNR | O43193 | 1/20 | 0.58 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.58 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.58 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.58 |
| ▸ | PDE6D | O43924 | 1/20 | 0.58 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.58 |
| ▸ | STK10 | O94804 | 1/20 | 0.58 |
| ▸ | CDK14 | O94921 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL4344749 | 0.89 | RAF1 (0.78) | RAF1CDK8KDRBRAFFLT1 | |
| SCHEMBL9926369 | 0.86 | RAF1 (0.85) | RAF1CDK8KDRBRAFFLT1 | |
| SCHEMBL9926366 | 0.80 | RAF1 (0.85) | RAF1CDK8KDRBRAFFLT1 | |
| SCHEMBL545646 | 0.79 | RAF1 (0.56) | RAF1CDK8KDRBRAFFLT1 | |
| Hydrochloric Acid SCHEMBL545435 | 0.79 | RAF1 (0.55) | RAF1CDK8KDRBRAFFLT1 | |
| SCHEMBL3711970 | 0.78 | RAF1 (0.77) | RAF1CDK8KDRBRAFFLT1 | |
| SCHEMBL29918250 | 0.77 | RAF1 (1.00) | RAF1CDK8KDRBRAFFLT1 | |
| SCHEMBL548133 | 0.77 | RAF1 (1.00) | RAF1CDK8KDRBRAFFLT1 | |
| SCHEMBL21203228 | 0.77 | RAF1 (0.58) | RAF1CDK8KDRBRAFFLT1 | |
| SCHEMBL12848167 | 0.77 | RAF1 (0.75) | RAF1CDK8KDRBRAFFLT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008115263-A2 | RAF KINASE INHIBITORS CONTAINING A ZINC BINDING MOIETY | CURIS, INC. (US) | 2008-09-25 | — | — | WO | disclosed |
| WO-2008033747-A9 | MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS | CURIS INC (MA) | 2008-07-24 | — | — | WO | disclosed |
| WO-2008033747-A2 | MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS | CURIS, INC. (US) | 2008-03-20 | — | — | WO | disclosed |