Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 6/20 | 0.38 |
| ▸ | BCAT2 | O15382 | 7/20 | 0.36 |
| ▸ | BCAT1 | P54687 | 7/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL6984454 | 0.85 | BCAT1 (0.42) | BCAT2BCAT1 | |
| SCHEMBL7695435 | 0.80 | PGR (0.40) | BCAT2BCAT1ALDH1A1 | |
| SCHEMBL7085889 | 0.75 | TRPV4 (0.37) | TRPV4BCAT2BCAT1CYP11B1CYP11B2 | |
| SCHEMBL7753821 | 0.75 | CYP11B1 (0.41) | TRPV4BCAT2BCAT1CYP11B1CYP11B2 | |
| SCHEMBL9599435 | 0.73 | ESR1 (0.43) | KDM4EALDH1A1GAA | |
| SCHEMBL9598055 | 0.73 | SMN1; SMN2 (0.41) | KDM4EALDH1A1GAA | |
| SCHEMBL9730810 | 0.72 | GABRB3 (0.37) | TRPV4KDM4EALDH1A1GAA | |
| SCHEMBL10679727 | 0.70 | CA2 (0.36) | GAA | |
| SCHEMBL11954634 | 0.69 | ALK (0.47) | TRPV4ALDH1A1 | |
| SCHEMBL9598871 | 0.69 | ALDH1A1 (0.48) | KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002020487-A1 | SUBSTITUTED 1-ARYL-PYRIDIN-2-(THI)ONES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-03-14 | — | — | WO | disclosed |