Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 16/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.53 |
| ▸ | PGR | P06401 | 1/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10939485 | 1.00 | CYP19A1 (0.76) | CYP19A1CYP3A4NR3C1PGRCHRM2 | |
| SCHEMBL948011 | 0.86 | CYP19A1 (1.00) | CYP19A1CYP3A4NR3C1PGRCHRM2 | |
| SCHEMBL22863539 | 0.86 | CYP19A1 (1.00) | CYP19A1CYP3A4NR3C1PGRCHRM2 | |
| SCHEMBL12917459 | 0.86 | CYP19A1 (1.00) | CYP19A1CYP3A4NR3C1PGRCHRM2 | |
| SCHEMBL13753075 | 0.86 | CYP19A1 (1.00) | CYP19A1CYP3A4NR3C1PGRCHRM2 | |
| SCHEMBL10938942 | 0.86 | CYP19A1 (1.00) | CYP19A1CYP3A4NR3C1PGRCHRM2 | |
| SCHEMBL3985545 | 0.82 | CYP19A1 (0.65) | CYP19A1NR3C1PGROPRK1ALDH1A1 | |
| SCHEMBL8941701 | 0.80 | CYP19A1 (0.70) | CYP19A1 | |
| SCHEMBL7099941 | 0.80 | CYP19A1 (0.78) | CYP19A1CYP3A4NR3C1PGRCHRM2 | |
| SCHEMBL7099947 | 0.80 | CYP19A1 (0.78) | CYP19A1CYP3A4NR3C1PGRCHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0161492-A2 | Estrogen synthesis inhibitors | THE ROCKEFELLER UNIVERSITY (US) | 1985-11-21 | — | — | EP | claimed |
| US-4546098-A | ANTIESTROGENS; HORMONE INHIBITORS | THE ROCKEFELLER UNIVERSITY (US) | 1985-10-08 | — | — | US | claimed |
| EP-0161492-A2 | Estrogen synthesis inhibitors | THE ROCKEFELLER UNIVERSITY (US) | 1985-11-21 | — | — | EP | disclosed |
| US-4546098-A | ANTIESTROGENS; HORMONE INHIBITORS | THE ROCKEFELLER UNIVERSITY (US) | 1985-10-08 | — | — | US | disclosed |