Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 14/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1373374 | 1.00 | AR (0.50) | ARCYP19A1ALDH1A1HPGDNPSR1 | |
| SCHEMBL19280731 | 0.93 | ESR1 (0.50) | ARCYP19A1ALDH1A1HPGDNPSR1 | |
| SCHEMBL522240 | 0.87 | AR (0.56) | ARCYP19A1ALDH1A1HPGDNPSR1 | |
| SCHEMBL9745960 | 0.87 | AR (0.56) | ARCYP19A1ALDH1A1HPGDNPSR1 | |
| SCHEMBL12215129 | 0.83 | AR (0.38) | ARCYP19A1ALDH1A1HPGDNPSR1 | |
| SCHEMBL20230322 | 0.83 | L3MBTL1 (0.48) | ARCYP19A1NPSR1 | |
| SCHEMBL1377229 | 0.82 | CYP19A1 (0.62) | ARCYP19A1ALDH1A1HPGDNPSR1 | |
| SCHEMBL9472016 | 0.82 | CYP19A1 (0.62) | ARCYP19A1ALDH1A1HPGDNPSR1 | |
| SCHEMBL8426309 | 0.82 | AR (0.46) | ARCYP19A1ALDH1A1HPGDNPSR1 | |
| SCHEMBL9746494 | 0.81 | AR (0.55) | ARCYP19A1ALDH1A1HPGDNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112961323-B | Fluorinated benzonitrile and fluorinated epoxy resin composite material and preparation method thereof | 广东炜林纳新材料科技股份有限公司 | 2023-06-06 | — | — | CN | disclosed |