Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 7/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.37 |
| ▸ | WDR5 | P61964 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6016394 | 0.80 | KDM4E (0.43) | — | |
| SCHEMBL6016339 | 0.78 | CHRM2 (0.43) | KMT2A | |
| Dimethylaminoethanol SCHEMBL6016335 | 0.76 | ALDH1A1 (0.43) | — | |
| SCHEMBL6016503 | 0.74 | KDM4E (0.41) | — | |
| SCHEMBL6016603 | 0.73 | TACR1 (0.50) | TACR1 | |
| SCHEMBL7704059 | 0.70 | TACR1 (0.51) | TACR1HSP90AA1HSP90AB1KMT2A | |
| SCHEMBL6016671 | 0.69 | TACR1 (0.49) | TACR1 | |
| SCHEMBL6016572 | 0.69 | MAPK14 (0.48) | KMT2A | |
| SCHEMBL6866620 | 0.68 | ALDH1A1 (0.44) | — | |
| SCHEMBL6016508 | 0.68 | KDM4E (0.38) | HSP90AA1 |
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-1187815-B1 | 4-PHENYL-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2006-02-08 | — | — | EP | disclosed |