Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 15/20 | 0.50 |
| ▸ | HSP90AB1 | P08238 | 10/20 | 0.50 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | CSF1R | P07333 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | COMT | P21964 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13627483 | 0.89 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1SIGMAR1KDM4EALDH1A1 | |
| SCHEMBL13627491 | 0.87 | HSP90AA1 (0.65) | HSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL13627487 | 0.86 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL13627519 | 0.86 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1ALDH1A1SMN1; SMN2HTR7 | |
| SCHEMBL13627512 | 0.85 | SMN1; SMN2 (0.52) | HSP90AA1HSP90AB1ROCK2PRKD3CSF1R | |
| SCHEMBL13627475 | 0.85 | HSP90AA1 (0.70) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627488 | 0.85 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1COMT | |
| SCHEMBL13627503 | 0.85 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627505 | 0.84 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627468 | 0.84 | HSP90AA1 (0.63) | HSP90AA1HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7612201-B2 | Pyrazole compounds | VERNALIS (CAMBRIDGE) LIMITED (GB) | 2009-11-03 | — | — | US | disclosed |
| US-7612201-B2 | Pyrazole compounds | VERNALIS (CAMBRIDGE) LIMITED (GB) | 2009-11-03 | — | — | US | disclosed |