Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.50 |
| ▸ | STS | P08842 | 3/20 | 0.46 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.44 |
| ▸ | HSD17B3 | P37058 | 3/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 8/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SHBG | P04278 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13125425 | 0.84 | ESR1 (0.57) | ESR1ESR2STSCYP19A1HSD17B1 | |
| SCHEMBL15292941 | 0.84 | ESR1 (0.57) | ESR1ESR2STSCYP19A1HSD17B1 | |
| SCHEMBL11758322 | 0.84 | ESR1 (0.57) | ESR1ESR2STSCYP19A1HSD17B1 | |
| SCHEMBL1688725 | 0.83 | ESR1 (0.71) | ESR1ESR2STSCYP19A1HSD17B1 | |
| SCHEMBL11222251 | 0.80 | STS (0.60) | ESR1ESR2STSCYP19A1HSD17B1 | |
| SCHEMBL11671496 | 0.80 | STS (0.60) | ESR1ESR2STSCYP19A1HSD17B1 | |
| SCHEMBL8048295 | 0.80 | STS (0.60) | ESR1ESR2STSCYP19A1HSD17B1 | |
| SCHEMBL15295783 | 0.78 | STS (0.57) | ESR1ESR2STSCYP19A1HSD17B1 | |
| SCHEMBL8048190 | 0.77 | SHBG (0.40) | SRD5A1SHBG | |
| SCHEMBL8038167 | 0.77 | SHBG (0.40) | SRD5A1SHBG |
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 |
|---|---|---|---|---|---|---|---|
| EP-0882735-B1 | 9 Alpha-hydroxy-8 alpha-estra-1,3,5(10)-trienes and a process for their preparation | JENAPHARM GMBH (DE) | 2000-04-19 | — | — | EP | disclosed |
| EP-0882735-A1 | 9 Alpha-hydroxy-8 alpha-estra-1,3,5(10)-trienes and a process for their preparation | Jenapharm GmbH & Co. KG (DE) | 1998-12-09 | — | — | EP | disclosed |