Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | F2RL1 | P55085 | 10/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9803992 | 0.87 | CYP19A1 (0.43) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7905623 | 0.85 | FPR2 (0.40) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL19642925 | 0.83 | CYP1A2 (0.44) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11230021 | 0.83 | CHRM2 (0.48) | CYP19A1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL10686017 | 0.82 | CYP19A1 (0.45) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL28566835 | 0.78 | CYP1A2 (0.36) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14880753 | 0.78 | CYP1A2 (0.42) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL12112001 | 0.78 | CYP19A1 (0.47) | CYP19A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8101640 | 0.78 | CYP19A1 (0.47) | CYP19A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Oxalic Acid SCHEMBL1507978 | 0.77 | ADRA2A (0.42) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6197975-B1 | 7-AZABICYCLO(2.2.1)HEPTANE-7-CARBONYL-SUBSTITUTED 2-PHENYLINDOLE DERIVATIVES; SEXUAL DISORDERS; ANTICARCINOGENIC AGENTS | MERCK & CO. , INC. | 2001-03-06 | — | — | US | disclosed |
| EP-0882040-A4 | ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE | MERCK & CO INC (US) | 1999-02-10 | — | — | EP | disclosed |
| EP-0882040-A1 | ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE | Merck & Co., Inc. (US) | 1998-12-09 | — | — | EP | disclosed |
| WO-1997021707-A1 | ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE | MERCK & CO., INC. (US) | 1997-06-19 | — | — | WO | disclosed |