Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 3/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8926272 | 0.81 | NR1H4 (0.37) | NR1H4SRD5A2ACHEHTT | |
| SCHEMBL8926793 | 0.80 | SRD5A1 (0.53) | SRD5A2SRD5A1 | |
| SCHEMBL8927240 | 0.78 | SRD5A2 (0.32) | SRD5A2ARKCNH2 | |
| SCHEMBL8925513 | 0.78 | SRD5A2 (0.36) | NR1H4SRD5A2ACHEHTT | |
| SCHEMBL8927002 | 0.77 | AR (0.39) | SRD5A2ARKCNH2HSD17B3 | |
| SCHEMBL8926721 | 0.77 | PGR (0.31) | ARKCNH2 | |
| SCHEMBL8926809 | 0.74 | SRD5A1 (0.37) | SRD5A2HTTSRD5A1ARKCNH2 | |
| SCHEMBL8925443 | 0.71 | AR (0.34) | SRD5A2ARKCNH2 | |
| SCHEMBL8925996 | 0.70 | ALDH1A1 (0.37) | SRD5A2ACHEBCHEKCNH2 | |
| SCHEMBL9113667 | 0.69 | SRD5A1 (0.42) | SRD5A2SRD5A1AR |
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 |
|---|---|---|---|---|---|---|---|
| US-5693809-A | PREGNANES FOR TREATING ALOPECIA, ACNE AND SKIN DISORDER | MERCK & CO., INC. (US) | 1997-12-02 | — | — | US | disclosed |