Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | HSP90AA1 | P07900 | 15/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 15/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13627497 | 0.90 | HSP90AA1 (0.46) | ALDH1A1NPSR1HSP90AA1HSP90AB1GSK3B | |
| SCHEMBL13627487 | 0.87 | HSP90AA1 (0.49) | ALDH1A1NPSR1HSP90AA1HSP90AB1KMT2A | |
| SCHEMBL13627481 | 0.82 | HSP90AA1 (0.48) | ALDH1A1NPSR1HSP90AA1HSP90AB1KMT2A | |
| SCHEMBL13627519 | 0.82 | HSP90AA1 (0.51) | ALDH1A1NPSR1HSP90AA1HSP90AB1 | |
| SCHEMBL13627494 | 0.81 | HSP90AA1 (0.50) | ALDH1A1HSP90AA1HSP90AB1KDM4EPDK1 | |
| SCHEMBL13627483 | 0.81 | HSP90AA1 (0.53) | ALDH1A1HSP90AA1HSP90AB1KMT2AKDM4E | |
| SCHEMBL13627503 | 0.81 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627505 | 0.80 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627475 | 0.79 | HSP90AA1 (0.70) | HSP90AA1HSP90AB1LMNA | |
| SCHEMBL13627491 | 0.79 | HSP90AA1 (0.65) | ALDH1A1HSP90AA1HSP90AB1LMNA |
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 |