Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARD | Q03181 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 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 | |
|---|---|---|---|---|
| SCHEMBL7945863 | 0.98 | CA2 (0.52) | CA2ALDH1A1PPARGPPARDPPARA | |
| SCHEMBL7956564 | 0.93 | CA2 (0.53) | CA2ALDH1A1PPARGPPARDPPARA | |
| SCHEMBL7959717 | 0.86 | CA2 (0.57) | CA2ALDH1A1PPARGPPARDPPARA | |
| SCHEMBL7383706 | 0.86 | CA2 (0.49) | CA2ALDH1A1PPARGPPARDPPARA | |
| SCHEMBL27519166 | 0.85 | CA2 (0.52) | CA2ATMKDM4EL3MBTL1 | |
| SCHEMBL2096903 | 0.84 | KMT2A (0.46) | ALDH1A1ATMKDM4EL3MBTL1TDP1 | |
| SCHEMBL7955079 | 0.84 | PTGS2 (0.46) | ALDH1A1KDM4EPOLBCYP19A1CYP3A4 | |
| SCHEMBL7390066 | 0.84 | CA2 (0.50) | CA2ALDH1A1PPARGPPARDPPARA | |
| SCHEMBL8337378 | 0.83 | CA2 (0.53) | CA2ALDH1A1PPARGPPARDPPARA | |
| SCHEMBL7952895 | 0.82 | PTGS2 (0.47) | ALDH1A1KDM4EPOLBCYP19A1CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6245779-B1 | ANALGESICS; ANTIINFLAMMATORY AGENTS | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 2001-06-12 | — | — | US | disclosed |
| EP-0997463-A1 | NAPHTHYRIDINE DERIVATIVES | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 2000-05-03 | — | — | EP | disclosed |