Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 8/20 | 0.53 |
| ▸ | HSP90AB1 | P08238 | 8/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | CCR3 | P51677 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.40 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.40 |
| ▸ | PRKAB1 | Q9Y478 | 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 | |
|---|---|---|---|---|
| SCHEMBL13627495 | 0.92 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1CNR1 | |
| SCHEMBL13627503 | 0.91 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627481 | 0.90 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1KDM4ENPSR1 | |
| SCHEMBL13627515 | 0.89 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627491 | 0.89 | HSP90AA1 (0.65) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627505 | 0.84 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627519 | 0.84 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1NPSR1 | |
| SCHEMBL13627486 | 0.83 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1FAAH | |
| SCHEMBL13627483 | 0.83 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1KDM4E | |
| SCHEMBL13627487 | 0.82 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1KDM4ENPSR1 |
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 |