Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 19/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10580900 | 1.00 | CYP19A1 (0.61) | CYP19A1ALDH1A1HPGD | |
| SCHEMBL10584812 | 0.93 | CYP19A1 (0.56) | CYP19A1 | |
| SCHEMBL10584822 | 0.93 | CYP19A1 (0.56) | CYP19A1 | |
| SCHEMBL10583517 | 0.79 | CYP19A1 (0.52) | CYP19A1 | |
| SCHEMBL10583527 | 0.79 | CYP19A1 (0.52) | CYP19A1 | |
| SCHEMBL4787857 | 0.78 | CYP19A1 (0.81) | CYP19A1 | |
| SCHEMBL10172832 | 0.76 | CYP19A1 (1.00) | CYP19A1 | |
| SCHEMBL10583639 | 0.71 | CYP11B1 (0.56) | CYP19A1 | |
| SCHEMBL10583642 | 0.71 | CYP11B1 (0.56) | CYP19A1 | |
| SCHEMBL7061036 | 0.70 | CYP11B1 (0.57) | CYP19A1 |
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-0299683-A2 | Heterocyclic olefinic compounds and their use as aromatase inhibitors | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-01-18 | — | — | EP | claimed |