Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 8/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5070199 | 1.00 | AR (0.54) | ARKCNH2CYP19A1 | |
| SCHEMBL5070221 | 0.84 | AR (0.54) | ARKCNH2CYP19A1 | |
| SCHEMBL5070986 | 0.84 | AR (0.65) | ARKCNH2CYP19A1 | |
| SCHEMBL5070224 | 0.84 | AR (0.65) | ARKCNH2CYP19A1 | |
| SCHEMBL5070948 | 0.78 | AR (0.64) | ARKCNH2CYP19A1 | |
| SCHEMBL5070951 | 0.78 | AR (0.64) | ARKCNH2CYP19A1 | |
| SCHEMBL5070231 | 0.78 | AR (0.64) | ARKCNH2CYP19A1 | |
| SCHEMBL5070296 | 0.78 | AR (0.61) | ARKCNH2 | |
| SCHEMBL4278515 | 0.78 | AR (0.61) | ARKCNH2 | |
| SCHEMBL5069406 | 0.76 | AR (0.61) | ARKCNH2CYP19A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1467739-A4 | 17-HYDROXY-4-AZA-ANDROSTAN-3-ONES AS ANDROGEN RECEPTOR MODULATORS | MERCK & CO INC (US) | 2008-01-09 | — | — | EP | claimed |
| EP-1467739-A2 | 17-HYDROXY-4-AZA-ANDROSTAN-3-ONES AS ANDROGEN RECEPTOR MODULATORS | Merck & Co., Inc. (US) | 2004-10-20 | — | — | EP | claimed |
| WO-2003059293-A2 | 17-HYDROXY-4-AZA-ANDROSTAN-3-ONES AS ANDROGEN RECEPTOR MODULATORS | MERCK & CO., INC. (US) | 2003-07-24 | — | — | WO | claimed |