Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 7/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 8/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11702709 | 0.89 | CYP19A1 (0.46) | CYP17A1CYP19A1CYP3A4 | |
| SCHEMBL11704052 | 0.81 | CYP17A1 (0.36) | CYP17A1CYP19A1CYP3A4 | |
| SCHEMBL11701108 | 0.78 | CYP17A1 (0.45) | CYP17A1CYP19A1CYP3A4 | |
| SCHEMBL11705294 | 0.73 | SLC6A3 (0.40) | SLC6A2SLC6A4SLC6A3CYP19A1CYP3A4 | |
| SCHEMBL11700968 | 0.73 | CYP19A1 (0.42) | CYP17A1SLC6A2SLC6A4CYP19A1 | |
| SCHEMBL11703636 | 0.72 | CYP17A1 (0.40) | CYP17A1SLC6A4CYP19A1CYP3A4 | |
| SCHEMBL11242020 | 0.72 | CYP11B1 (0.45) | CYP17A1CYP19A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL11246004 | 0.71 | CYP11B1 (0.44) | CYP17A1CYP19A1CYP3A4 | |
| SCHEMBL10467216 | 0.71 | CYP19A1 (0.44) | CYP17A1SLC6A2SLC6A4SLC6A3CYP19A1 | |
| SCHEMBL11704060 | 0.70 | CYP17A1 (0.39) | CYP17A1CYP19A1CYP3A4 |
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-4006243-A | FUNGICIDE, BACTERICIDE, YEAST | SCHERING AKTIENGESELLSCHAFT (DT) | 1977-02-01 | — | — | US | disclosed |