Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.56 |
| ▸ | PGR | P06401 | 3/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.56 |
| ▸ | AR | P10275 | 2/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.56 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11244087 | 0.84 | ESR1 (0.56) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL3451745 | 0.81 | ESR1 (0.58) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL9558275 | 0.81 | ESR1 (0.58) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL2835200 | 0.79 | ALOX15 (0.53) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL14518723 | 0.78 | MAPT (0.58) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL2767885 | 0.78 | MAPT (0.58) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL1650591 | 0.78 | ALOX15 (0.60) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL11126965 | 0.78 | ALOX15 (0.52) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL4218400 | 0.78 | ALOX15 (0.55) | ESR1PGRSLC6A4CYP2C19ALOX15 | |
| SCHEMBL6463142 | 0.78 | ESR1 (0.55) | ESR1PGRSLC6A4CYP2C19ALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991001994-A1 | 11β-SUBSTITUTED 16α,17α-METHYLENE-ESTRA-4,9-DIENE-3-ONES | SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) | 1991-02-21 | — | — | WO | disclosed |
| EP-0411736-A1 | 11-Beta substituted 16-alpha, 17-alpha-methylene-estra-4,9-dien-3-one | SCHERING AKTIENGESELLSCHAFT (DE) | 1991-02-06 | — | — | EP | disclosed |