Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 10/20 | 0.58 |
| ▸ | SRD5A2 | P31213 | 9/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | HSD3B1 | P14060 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7750023 | 1.00 | SRD5A1 (0.58) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL7750240 | 0.84 | SRD5A2 (0.56) | SRD5A1SRD5A2 | |
| SCHEMBL7750353 | 0.84 | SRD5A2 (0.56) | SRD5A1SRD5A2 | |
| SCHEMBL7750235 | 0.84 | SRD5A2 (0.56) | SRD5A1SRD5A2 | |
| SCHEMBL7750357 | 0.84 | SRD5A2 (0.56) | SRD5A1SRD5A2 | |
| SCHEMBL7751208 | 0.81 | SRD5A1 (0.61) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL7751204 | 0.81 | SRD5A1 (0.61) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL9115755 | 0.80 | GPBAR1 (0.38) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8499598 | 0.78 | SRD5A1 (0.60) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8499595 | 0.78 | SRD5A1 (0.60) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0649306-B1 | ESTER DERIVATIVES OF 4-AZA-STEROIDS | MERCK & CO INC (US) | 2001-01-10 | — | — | EP | claimed |
| WO-1993023041-A1 | ESTER DERIVATIVES OF 4-AZA-STEROIDS | MERCK & CO., INC. (US) | 1993-11-25 | — | — | WO | claimed |
| EP-0649306-B1 | ESTER DERIVATIVES OF 4-AZA-STEROIDS | MERCK & CO INC (US) | 2001-01-10 | — | — | EP | disclosed |
| US-5693809-A | PREGNANES FOR TREATING ALOPECIA, ACNE AND SKIN DISORDER | MERCK & CO., INC. (US) | 1997-12-02 | — | — | US | disclosed |
| EP-0778284-A2 | New 7-beta-substituted-4-aza-5alpha-androstan-3-ones as 5alpha-reductase inhibitors | MERCK & CO. INC. (US) | 1997-06-11 | — | — | EP | disclosed |
| US-5610162-A | ENZYME INHIBITORS | MERCK & CO., INC. (US) | 1997-03-11 | — | — | US | disclosed |
| EP-0649306-A4 | ESTER DERIVATIVES OF 4-AZA-STEROIDS. | MERCK & CO INC (US) | 1995-08-23 | — | — | EP | disclosed |
| EP-0649306-A1 | ESTER DERIVATIVES OF 4-AZA-STEROIDS | MERCK & CO. INC. (US) | 1995-04-26 | — | — | EP | disclosed |
| EP-0572166-A1 | New 7beta-substituted-4-aza-5a-androstan-3-ones as 5a-reductase inhibitors | MERCK & CO. INC. (US) | 1993-12-01 | — | — | EP | disclosed |
| WO-1993023039-A1 | SUBSTITUTED 4-AZA-5A-ANDROSTAN-ONES AS 5A-REDUCTASE INHIBITORS | MERCK & CO., INC. (US) | 1993-11-25 | — | — | WO | disclosed |
| WO-1993023041-A1 | ESTER DERIVATIVES OF 4-AZA-STEROIDS | MERCK & CO., INC. (US) | 1993-11-25 | — | — | WO | disclosed |