Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 6/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 3/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11273980 | 0.93 | CYP11B1 (0.47) | IDO1CYP19A1CYP11B1CYP11B2TDP1 | |
| SCHEMBL11275707 | 0.93 | ALDH1A1 (0.48) | IDO1CYP19A1CYP11B1CYP11B2CYP2A6 | |
| SCHEMBL11285968 | 0.89 | CYP11B1 (0.44) | IDO1CYP19A1CYP11B1CYP11B2CYP1A2 | |
| SCHEMBL11272044 | 0.87 | IDO1 (0.55) | IDO1CYP19A1CYP11B1CYP11B2CYP1A2 | |
| SCHEMBL11272425 | 0.87 | ALDH1A1 (0.53) | IDO1CYP19A1CYP11B1CYP11B2CYP2A6 | |
| SCHEMBL11278619 | 0.87 | ALDH1A1 (0.53) | IDO1CYP19A1CYP11B1CYP11B2CYP2A6 | |
| SCHEMBL11277864 | 0.85 | CYP11B1 (0.48) | IDO1CYP19A1CYP11B1CYP11B2CYP1A2 | |
| SCHEMBL11285364 | 0.84 | CYP2C9 (0.52) | IDO1CYP19A1CYP11B1CYP11B2CYP2A6 | |
| SCHEMBL11274846 | 0.84 | IDO1 (0.43) | IDO1CYP19A1CYP11B1CYP11B2CYP1A2 | |
| SCHEMBL11283021 | 0.83 | ALDH1A1 (0.58) | CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6 |
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-0064244-A1 | Spermicidal 1-bis(arylalkyl)alkylimidazoles | SYNTEX (U.S.A.) INC. (US) | 1982-11-10 | — | — | EP | disclosed |