Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 6/20 | 0.55 |
| ▸ | SRD5A2 | P31213 | 6/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | HSD3B1 | P14060 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7901226 | 1.00 | SRD5A1 (0.55) | SRD5A1SRD5A2CYP19A1LMNACYP3A4 | |
| SCHEMBL9114837 | 0.85 | SRD5A1 (0.43) | SRD5A1SRD5A2CYP19A1LMNACYP3A4 | |
| SCHEMBL8135045 | 0.83 | SRD5A1 (0.52) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8135928 | 0.83 | SRD5A1 (0.52) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8135041 | 0.83 | SRD5A1 (0.52) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL9134036 | 0.79 | SRD5A1 (0.52) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL9134039 | 0.79 | SRD5A1 (0.52) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL4278336 | 0.79 | SRD5A1 (0.66) | SRD5A1SRD5A2CYP19A1LMNACYP3A4 | |
| SCHEMBL4265542 | 0.79 | SRD5A1 (0.66) | SRD5A1SRD5A2CYP19A1LMNACYP3A4 | |
| SCHEMBL4265535 | 0.79 | SRD5A1 (0.66) | SRD5A1SRD5A2CYP19A1LMNACYP3A4 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6187925-B1 | TREATING IODINATED AZASTEROID WITH POTASSIUM TERT-BUTOXIDE, ISOLATING ENE STEROID | MERCK & CO., INC. | 2001-02-13 | — | — | US | disclosed |
| EP-1042356-A2 | INTERMEDIATES AND PROCESS FOR THE SYNTHESIS OF 17-UNSUBSTITUTED 16.BETA.-ARYLOXY 4-AZASTEROIDS | Merck & Co., Inc. (US) | 2000-10-11 | — | — | EP | disclosed |
| WO-1999032507-A2 | INTERMEDIATES AND PROCESS FOR THE SYNTHESIS OF 17-UNSUBSTITUTED 16.BETA.-ARYLOXY 4-AZASTEROIDS | MERCK & CO., INC. (US) | 1999-07-01 | — | — | WO | disclosed |
| EP-0862556-A4 | 17-ALKYL-7-SUBSTITUTED-4-AZA STEROID DERIVATIVES | MERCK & CO INC (US) | 1999-02-03 | — | — | EP | disclosed |
| EP-0862556-A1 | 17-ALKYL-7-SUBSTITUTED-4-AZA STEROID DERIVATIVES | Merck & Co., Inc. (US) | 1998-09-09 | — | — | EP | disclosed |
| WO-1998009632-A1 | METHODS AND COMPOSITIONS FOR TREATING PRETERM LABOR | MERCK & CO., INC. (US) | 1998-03-12 | — | — | WO | disclosed |
| WO-1997015558-A1 | 17-ALKYL-7-SUBSTITUTED-4-AZA STEROID DERIVATIVES | MERCK & CO., INC. (US) | 1997-05-01 | — | — | WO | disclosed |