Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 9/20 | 0.51 |
| ▸ | HSP90AB1 | P08238 | 9/20 | 0.51 |
| ▸ | GPR6 | P46095 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 4/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 3/20 | 0.41 |
| ▸ | DRD3 | P35462 | 3/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 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 | |
|---|---|---|---|---|
| SCHEMBL13627488 | 0.91 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1DRD2DRD4DRD3 | |
| SCHEMBL13627491 | 0.87 | HSP90AA1 (0.65) | HSP90AA1HSP90AB1DRD2DRD4DRD3 | |
| SCHEMBL13627498 | 0.83 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1FAAH | |
| SCHEMBL13627483 | 0.83 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627495 | 0.83 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1DRD2HTR1A | |
| SCHEMBL13627489 | 0.82 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1GPR6DRD2DRD4 | |
| SCHEMBL13627469 | 0.82 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1DRD2DRD4DRD3 | |
| SCHEMBL13627473 | 0.81 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627481 | 0.81 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627515 | 0.80 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1DRD2HTR1A |
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 |