Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 14/20 | 0.49 |
| ▸ | MET | P08581 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9105444 | 0.90 | KDR (0.45) | KDRMETBRAFHIPK4CCNC | |
| SCHEMBL9102135 | 0.87 | RAF1 (0.55) | KDRMETBRAFHDAC1HIPK4 | |
| SCHEMBL9103507 | 0.87 | KMT2A (0.43) | KDRKDM4EUSP2LMNAHPGD | |
| SCHEMBL4467015 | 0.86 | KDR (0.59) | KDRMETBRAFHIPK4CCNC | |
| SCHEMBL5724635 | 0.83 | KDR (0.53) | KDRBRAFHIPK4CDK8RAF1 | |
| SCHEMBL9100193 | 0.83 | CDK8 (0.42) | KDRMETBRAFHIPK4LMNA | |
| SCHEMBL9099762 | 0.82 | KDR (0.42) | KDRBRAFHIPK4RAF1 | |
| SCHEMBL9102040 | 0.81 | CDK8 (0.45) | KDRLMNACDK8 | |
| SCHEMBL9101755 | 0.79 | RET (0.55) | KDRMETBRAFHDAC1HIPK4 | |
| SCHEMBL9100020 | 0.79 | RAF1 (0.55) | KDRBRAFHIPK4KDM4ELMNA |
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 1 patent. 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 | disclosed |