Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 7/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14278771 | 0.94 | MAPK1 (0.49) | HPGDALDH1A1CYP1A2CYP2C19MAPK1 | |
| SCHEMBL14278772 | 0.79 | MAPK1 (0.49) | HPGDALDH1A1CYP1A2CYP2C19MAPK1 | |
| SCHEMBL14286163 | 0.78 | GSK3B (0.49) | HPGDALDH1A1CYP1A2CYP2C19MAPK1 | |
| SCHEMBL10067975 | 0.77 | ALDH1A1 (0.46) | HPGDALDH1A1CYP1A2CYP2C19MEN1 | |
| SCHEMBL14286155 | 0.77 | NPC1 (0.53) | HPGDALDH1A1CYP1A2CYP2C19MAPK1 | |
| SCHEMBL14286165 | 0.77 | GSK3B (0.51) | HPGDALDH1A1CYP1A2CYP2C19MAPK1 | |
| SCHEMBL14286151 | 0.74 | ADORA2A (0.39) | MAPK1MAPK10MEN1KMT2A | |
| SCHEMBL14278709 | 0.74 | ALDH1A1 (0.54) | HPGDALDH1A1CYP1A2CYP2C19MAPK1 | |
| SCHEMBL14286137 | 0.74 | MAPK1 (0.53) | HPGDALDH1A1CYP1A2CYP2C19MAPK1 | |
| SCHEMBL14286127 | 0.72 | GSK3B (0.56) | HPGDALDH1A1CYP1A2CYP2C19MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7314885-B2 | Pyrrole compounds useful as kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-01-01 | — | — | US | disclosed |