Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 4/20 | 0.62 |
| ▸ | PGR | P06401 | 12/20 | 0.58 |
| ▸ | NR3C1 | P04150 | 13/20 | 0.58 |
| ▸ | ESR1 | P03372 | 2/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.57 |
| ▸ | THRA | P10827 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | THPO | P40225 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL5395107 | 0.93 | AR (0.71) | ARPGRNR3C1ESR1ESR2 | |
| SCHEMBL5395109 | 0.93 | AR (0.71) | ARPGRNR3C1ESR1ESR2 | |
| SCHEMBL9146687 | 0.92 | AR (0.58) | ARPGRNR3C1ESR1ESR2 | |
| SCHEMBL9650258 | 0.90 | AR (0.57) | ARPGRNR3C1ESR1ESR2 | |
| SCHEMBL14670184 | 0.90 | AR (0.60) | ARPGRNR3C1ESR1ESR2 | |
| Aglepristone SCHEMBL16673291 | 0.88 | NR3C1 (0.72) | ARPGRNR3C1ESR1ESR2 | |
| Aglepristone SCHEMBL2108967 | 0.88 | NR3C1 (0.72) | ARPGRNR3C1ESR1ESR2 | |
| Aglepristone SCHEMBL9849187 | 0.88 | NR3C1 (0.72) | ARPGRNR3C1ESR1ESR2 | |
| Aglepristone SCHEMBL13625155 | 0.88 | NR3C1 (0.72) | ARPGRNR3C1ESR1ESR2 | |
| SCHEMBL14670140 | 0.86 | AR (0.56) | ARPGRNR3C1ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5089488-A | Anticarcinogenic agents; treating glaucoma, hypertension, diabetes, insomia, osteoporosis | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-02-18 | — | — | US | claimed |
| EP-0254670-B1 | 11-BETA-(4-ISOPROPENYLPHENYL)-ESTRA-4,9-DIENE, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SCHERING AKTIENGESELLSCHAFT (DE) | 1989-11-15 | — | — | EP | claimed |
| EP-0254670-A1 | 11-beta-(4-isopropenylphenyl)-estra-4,9-diene, their preparation and pharmaceutical compositions containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1988-01-27 | — | — | EP | disclosed |