Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 4/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.37 |
| ▸ | AR | P10275 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CDC25A | P30304 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8925157 | 0.85 | SRD5A2 (0.32) | SRD5A1SRD5A2ARNFKB1MAPK1 | |
| SCHEMBL8926431 | 0.85 | AR (0.33) | SRD5A2ARKCNH2 | |
| SCHEMBL8926954 | 0.80 | SRD5A1 (0.36) | SRD5A1SRD5A2ARALDH1A1HTT | |
| SCHEMBL8926800 | 0.80 | SRD5A1 (0.50) | SRD5A1SRD5A2 | |
| SCHEMBL8925443 | 0.77 | AR (0.34) | SRD5A2ARALDH1A1MAPTMAPK1 | |
| SCHEMBL8726903 | 0.76 | SRD5A1 (0.43) | SRD5A1SRD5A2ARALDH1A1 | |
| SCHEMBL8726908 | 0.76 | SRD5A1 (0.43) | SRD5A1SRD5A2ARALDH1A1 | |
| SCHEMBL9113667 | 0.76 | SRD5A1 (0.42) | SRD5A1SRD5A2ARALDH1A1MAPT | |
| SCHEMBL8927169 | 0.74 | G6PD (0.36) | SRD5A2ARKCNH2 | |
| SCHEMBL8926795 | 0.74 | NR1H4 (0.36) | SRD5A1SRD5A2ARHTTHSD17B3 |
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 |