Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 14/20 | 0.45 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.42 |
| ▸ | STS | P08842 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 2/20 | 0.38 |
| ▸ | VNN1 | O95497 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL28922397 | 0.90 | CYP19A1 (0.46) | CYP19A1STSKDM1A | |
| SCHEMBL8329384 | 0.89 | CYP19A1 (0.43) | CYP19A1NR1D1NR1H3STSCTSL | |
| SCHEMBL8327987 | 0.89 | CYP19A1 (0.42) | CYP19A1STSCTSLVNN1 | |
| SCHEMBL8328066 | 0.86 | CYP19A1 (0.44) | CYP19A1STS | |
| SCHEMBL8324262 | 0.86 | CYP19A1 (0.40) | CYP19A1STSCYP3A4VNN1 | |
| SCHEMBL8323103 | 0.85 | ESR1 (0.49) | CYP19A1NR1D1CTSLVNN1KDM1A | |
| SCHEMBL6063814 | 0.84 | CYP19A1 (0.38) | CYP19A1CTSLVNN1 | |
| SCHEMBL8323116 | 0.84 | CYP19A1 (0.39) | CYP19A1STSCTSLVNN1KDM1A | |
| SCHEMBL27287580 | 0.84 | CYP11B1 (0.44) | CYP19A1STSCTSL | |
| SCHEMBL8329428 | 0.83 | MAOA (0.42) | CYP19A1NR1D1NR1H3KDM1A |
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-0640595-B1 | SUBSTITUTED TERTIARY AMINO COMPOUND OR SALT THEREOF | YAMANOUCHI PHARMA CO LTD (JP) | 1999-03-24 | — | — | EP | disclosed |
| US-5538976-A | ANTICARCINOGENIC AGENTS AND ENZYME INHIBITORS FOR AROMATASE | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1996-07-23 | — | — | US | disclosed |
| EP-0640595-A1 | NOVEL SUBSTITUTED TERTIARY AMINO COMPOUND OR SALT THEREOF | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1995-03-01 | — | — | EP | disclosed |