Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.69 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.68 |
| ▸ | MAPT | P10636 | 3/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.68 |
| ▸ | RECQL | P46063 | 1/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.68 |
| ▸ | STS | P08842 | 9/20 | 0.64 |
| ▸ | CA1 | P00915 | 3/20 | 0.63 |
| ▸ | CA2 | P00918 | 3/20 | 0.63 |
| ▸ | CA9 | Q16790 | 3/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | ESR1 | P03372 | 2/20 | 0.63 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.63 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.63 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.63 |
| ▸ | CA4 | P22748 | 1/20 | 0.63 |
| ▸ | CA6 | P23280 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL1657830 | 1.00 | HSD11B1 (0.69) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL9644320 | 0.86 | HSD11B1 (0.66) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL7827752 | 0.86 | HSD11B1 (0.69) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL7830895 | 0.86 | HSD11B1 (0.69) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL11860501 | 0.85 | HSD11B1 (0.60) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL1657336 | 0.84 | HSD11B1 (0.67) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL5986176 | 0.84 | HSD11B1 (0.72) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL8081744 | 0.84 | HSD11B1 (0.52) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL13216951 | 0.84 | HSD11B1 (0.52) | HSD11B1HSD17B1MAPTLMNARECQL | |
| SCHEMBL11688245 | 0.83 | HSD11B1 (0.51) | HSD11B1HSD17B1MAPTLMNARECQL |
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-0815120-B1 | 17-DIFLUOROMETHYLENE-OESTRATRIENES | SCHERING AG (DE) | 2001-02-14 | — | — | EP | disclosed |
| US-6136800-A | STEROIDS | SCHERING AKTIENGESELLSCHAFT (DE) | 2000-10-24 | — | — | US | disclosed |
| US-6018062-A | SUCH AS 17-DIFLUOROMETHYLENE-ESTRA-1,3,5(10)-TRIEN-3-OL; USE AS ANTIOXIDANTS AND VASCULOPROTECTIVE AGENTS AS THEY CAUSE VASODILATOR NITROGEN OXIDE RELEASE AND PREVENT OXIDATION OF LDL CHOLESTEROL | SCHERING AKTIENGESELLSCHAFT (DE) | 2000-01-25 | — | — | US | disclosed |
| EP-0815120-A1 | 17-DIFLUOROMETHYLENE-OESTRATRIENES | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-01-07 | — | — | EP | disclosed |
| WO-1996028462-A1 | 17-DIFLUOROMETHYLENE-OESTRATRIENES | SCHERING AKTIENGESELLSCHAFT (DE) | 1996-09-19 | — | — | WO | disclosed |