Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 12/20 | 0.45 |
| ▸ | CDK8 | P49336 | 3/20 | 0.43 |
| ▸ | MET | P08581 | 3/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.39 |
| ▸ | CCNC | P24863 | 2/20 | 0.39 |
| ▸ | HIPK4 | Q8NE63 | 2/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.39 |
| ▸ | CIT | O14578 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | MUSK | O15146 | 1/20 | 0.39 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | MLNR | O43193 | 1/20 | 0.39 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.39 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.39 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.39 |
| ▸ | PDE6D | O43924 | 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 | |
|---|---|---|---|---|
| SCHEMBL9102040 | 0.92 | CDK8 (0.45) | KDRCDK8MEN1KMT2ARET | |
| SCHEMBL9102011 | 0.90 | KDR (0.49) | KDRCDK8METCCNCHIPK4 | |
| SCHEMBL4463501 | 0.87 | KDR (0.52) | KDRCDK8METAURKBCCNC | |
| SCHEMBL9102135 | 0.87 | RAF1 (0.55) | KDRCDK8METAURKBCCNC | |
| SCHEMBL9100193 | 0.85 | CDK8 (0.42) | KDRCDK8METAURKBCCNC | |
| SCHEMBL9103507 | 0.80 | KMT2A (0.43) | KDRMEN1KMT2ARAF1MAPK1 | |
| SCHEMBL9101755 | 0.80 | RET (0.55) | KDRCDK8METAURKBCCNC | |
| SCHEMBL4467857 | 0.79 | RET (0.51) | KDRCDK8METAURKBCCNC | |
| SCHEMBL5724635 | 0.79 | KDR (0.53) | KDRCDK8AURKBHIPK4MAPK14 | |
| SCHEMBL9103055 | 0.78 | LMNA (0.44) | KDRMEN1KMT2ARAF1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | claimed |
| EP-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | disclosed |