Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2176500 | 0.78 | TSHR (0.60) | TPMTCA1CA2ALDH1A1 | |
| SCHEMBL21694316 | 0.78 | HDAC6 (0.60) | TPMTCA1CA2HDAC1 | |
| SCHEMBL2144483 | 0.76 | HDAC8 (0.64) | TPMTCA1CA2TRPV1 | |
| SCHEMBL2992032 | 0.76 | MEN1 (0.55) | CA1CA2 | |
| SCHEMBL6968527 | 0.76 | ALDH1A1 (0.67) | CYP1A2HDAC1ALDH1A1GAA | |
| SCHEMBL23395298 | 0.76 | TPMT (0.52) | TPMTCA1CA2TRPV1GSK3B | |
| SCHEMBL1363640 | 0.76 | MPO (0.64) | TPMTCA1CA2TRPV1CYP1A2 | |
| SCHEMBL6973186 | 0.76 | OGG1 (0.61) | CA1CA2HDAC1ALDH1A1GAA | |
| SCHEMBL1987275 | 0.76 | ALDH1A1 (0.61) | CA1CA2CYP1A2ALDH1A1 | |
| SCHEMBL28139334 | 0.76 | LMNA (0.59) | CA1CA2CYP1A2CYP2C9HDAC1 |
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-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |