Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.35 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.35 |
| ▸ | CCKBR | P32239 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11750663 | 0.78 | CYP11B1 (0.35) | CYP11B1CYP11B2CYP19A1CHRM2CYP3A4 | |
| SCHEMBL11891094 | 0.78 | ALDH1A1 (0.41) | CYP11B1CYP11B2KCNN4MAPK1ABCB11 | |
| SCHEMBL2204500 | 0.77 | CYP11B1 (0.43) | CYP11B1CYP11B2CYP19A1KCNN4MAOA | |
| SCHEMBL16371592 | 0.77 | CYP11B1 (0.47) | CYP11B1CYP11B2CYP19A1KCNN4MAOA | |
| SCHEMBL27638465 | 0.77 | CYP11B1 (0.43) | CYP11B1CYP11B2CYP19A1KCNN4MAOA | |
| SCHEMBL11891091 | 0.75 | CYP11B1 (0.39) | CYP11B1CYP11B2CYP19A1KCNN4MAOA | |
| SCHEMBL12267644 | 0.74 | TDP1 (0.35) | CYP11B1CYP11B2CYP19A1LMNACYP3A4 | |
| SCHEMBL11891093 | 0.74 | CYP11B1 (0.38) | CYP11B1CYP11B2CYP19A1KCNN4MAOA | |
| SCHEMBL28459503 | 0.73 | NUDT1 (0.36) | CYP11B1CYP11B2LMNALDLRPCSK9 | |
| SCHEMBL25190881 | 0.73 | CYP11B1 (0.40) | CYP11B1CYP11B2CYP19A1KCNN4MAOA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3344619-B1 | PHENOXYMETHYL DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2020-10-28 | — | — | EP | disclosed |
| WO-2017037146-A1 | PHENOXYMETHYL DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2017-03-09 | — | — | WO | disclosed |
| WO-2008088937-A1 | QUINOLYNYLMETHYLIMIDIZOLES AS THERAPEUTIC AGENTS | ALLERGAN, INC. (US) | 2008-07-24 | — | — | WO | disclosed |