Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 4/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 11/20 | 0.52 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.48 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.46 |
| ▸ | SHBG | P04278 | 2/20 | 0.46 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11257890 | 1.00 | HSD17B3 (0.53) | HSD17B3CYP19A1AKR1B10AKR1B1OR51E2 | |
| SCHEMBL11235253 | 0.85 | CYP19A1 (0.51) | CYP19A1OR51E2GPBAR1SHBGSERPINA6 | |
| SCHEMBL11235256 | 0.85 | CYP19A1 (0.51) | CYP19A1OR51E2GPBAR1SHBGSERPINA6 | |
| SCHEMBL11239863 | 0.83 | SRD5A1 (0.43) | AKR1B10AKR1B1GPBAR1 | |
| SCHEMBL11239844 | 0.83 | SRD5A1 (0.43) | AKR1B10AKR1B1GPBAR1 | |
| SCHEMBL10185940 | 0.81 | CYP19A1 (0.55) | HSD17B3CYP19A1AKR1B10AKR1B1OR51E2 | |
| SCHEMBL11242981 | 0.79 | CYP17A1 (0.50) | GPBAR1 | |
| SCHEMBL11242975 | 0.79 | CYP17A1 (0.50) | GPBAR1 | |
| SCHEMBL11243490 | 0.79 | SRD5A2 (0.59) | AKR1B10AKR1B1GPBAR1LMNAMEN1 | |
| SCHEMBL11243498 | 0.79 | SRD5A2 (0.59) | AKR1B10AKR1B1GPBAR1LMNAMEN1 |
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-4317817-A | SKIN DISORDERS; ACEME; ENZYME INHIBITORS | RICHARDSON-MERRELL INC. (US) | 1982-03-02 | — | — | US | disclosed |