Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 9/20 | 0.59 |
| ▸ | SHBG | P04278 | 1/20 | 0.58 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.47 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ABCC4 | O15439 | 3/20 | 0.42 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Sulfamate SCHEMBL2451788 | 0.92 | STS (0.65) | STSSHBGAKR1C3HSD17B1CA1 | |
| SCHEMBL29446097 | 0.87 | SHBG (0.70) | STSSHBGAKR1C3HSD17B1CYP2C9 | |
| SCHEMBL13725675 | 0.87 | SHBG (0.70) | STSSHBGAKR1C3HSD17B1CYP2C9 | |
| SCHEMBL975788 | 0.87 | SHBG (0.70) | STSSHBGAKR1C3HSD17B1CYP2C9 | |
| SCHEMBL11096655 | 0.87 | SHBG (0.70) | STSSHBGAKR1C3HSD17B1CYP2C9 | |
| SCHEMBL30887214 | 0.87 | SHBG (0.70) | STSSHBGAKR1C3HSD17B1CYP2C9 | |
| SCHEMBL1258796 | 0.84 | SHBG (0.64) | STSSHBGAKR1C3HSD17B1CYP2C9 | |
| SCHEMBL1259385 | 0.80 | SHBG (0.67) | STSSHBGHSD17B1CA1CA2 | |
| SCHEMBL3381342 | 0.80 | SHBG (0.67) | STSSHBGHSD17B1CA1CA2 | |
| Serine SCHEMBL11346267 | 0.79 | SHBG (0.54) | STSSHBGAKR1C3HSD17B1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0775155-B1 | ESTRA-1,3,5(10)-TRIENE DERIVATIVES, METHODS OF PREPARING SUCH COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SCHERING AG (DE) | 2004-05-06 | — | — | EP | disclosed |
| CN-1057305-C | Estra-1,3,5 (10)-triene derivatives, methods of preparing such compounds and pharmaceutical compositions containing them | JENAPHARM GMBH (DE) | 2000-10-11 | — | — | CN | disclosed |
| CN-1156998-A | Estra-1, 3, 5(10) -triene derivatives, process for their preparation and pharmaceutical compositions containing them | JENAPHARM GMBH (DE) | 1997-08-13 | — | — | CN | disclosed |
| EP-0775155-A1 | ESTRA-1,3,5(10)-TRIENE DERIVATIVES, METHODS OF PREPARING SUCH COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Jenapharm GmbH & Co. KG (DE) | 1997-05-28 | — | — | EP | disclosed |
| WO-1996005216-A1 | ESTRA-1,3,5(10)-TRIENE DERIVATIVES, METHODS OF PREPARING SUCH COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | JENAPHARM GMBH (DE) | 1996-02-22 | — | — | WO | disclosed |