Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 5/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL10836499 | 0.73 | HSP90AA1 (0.45) | CYP19A1ALDH1A1TP53HSP90AA1CYP3A4 | |
| SCHEMBL7434574 | 0.70 | MEN1 (0.43) | CYP17A1CYP19A1ALDH1A1HPGDMEN1 | |
| SCHEMBL669608 | 0.70 | CYP17A1 (0.39) | CYP17A1CYP19A1 | |
| SCHEMBL4793589 | 0.68 | ALDH1A1 (0.47) | ALDH1A1HPGDMEN1CYP3A4MAPT | |
| SCHEMBL1267769 | 0.67 | CYP17A1 (0.82) | CYP17A1CYP19A1ALDH1A1HPGDMEN1 | |
| Hydrochloric Acid SCHEMBL28285792 | 0.66 | CYP17A1 (0.80) | CYP17A1CYP19A1ALDH1A1HPGDMEN1 | |
| Bromide SCHEMBL28938866 | 0.66 | CYP17A1 (0.80) | CYP17A1CYP19A1ALDH1A1HPGDMEN1 | |
| SCHEMBL4552738 | 0.66 | MEN1 (0.40) | ALDH1A1MEN1HTR2AKMT2ACASP3 | |
| SCHEMBL4569650 | 0.66 | CYP17A1 (0.50) | CYP17A1CYP19A1ALDH1A1HPGDMEN1 | |
| SCHEMBL461207 | 0.65 | CASP3 (0.44) | ALDH1A1HPGDMEN1PLA2G1BTP53 |
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-4619941-A | N-[(1H-imidazol-1-yl)alkyl]-1H-indolecarboxamides useful as thromboxane synthetase inhibitors and antihypertensive agents | AMERICAN CYANAMID COMPANY (US) | 1986-10-28 | — | — | US | disclosed |