Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 2/20 | 0.61 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.61 |
| ▸ | AR | P10275 | 6/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL8020892 | 1.00 | SRD5A2 (0.61) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL8852026 | 0.82 | SRD5A2 (0.60) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL8852024 | 0.82 | SRD5A2 (0.60) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL8587739 | 0.82 | SRD5A1 (0.65) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL8336717 | 0.82 | SRD5A1 (0.65) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL7380562 | 0.82 | SRD5A2 (0.76) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL8336709 | 0.82 | SRD5A1 (0.65) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL7417373 | 0.82 | SRD5A1 (0.65) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL7778952 | 0.82 | SRD5A2 (0.76) | SRD5A2SRD5A1ARKCNH2 | |
| SCHEMBL8588600 | 0.82 | SRD5A2 (0.76) | SRD5A2SRD5A1ARKCNH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0664812-B1 | 17-BETA-ARYL ESTER CARBOXYLATES OF 4-AZA-5-ALPHA-ANDROSTANE-3-ONES | MERCK & CO INC (US) | 2000-01-05 | — | — | EP | disclosed |