Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 5/20 | 0.57 |
| ▸ | CHEK2 | O96017 | 6/20 | 0.54 |
| ▸ | PIN1 | Q13526 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.44 |
| ▸ | GCGR | P47871 | 1/20 | 0.44 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.44 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21156706 | 0.86 | DHODH (0.48) | DHODHCHEK2PIN1CYP1A2CYP2C19 | |
| SCHEMBL8342056 | 0.79 | MAPK1 (0.50) | CHEK2PIN1CYP1A2CYP2C19MAPK1 | |
| SCHEMBL13309662 | 0.78 | HRH3 (0.50) | DHODHCHEK2PIN1MAPK1 | |
| SCHEMBL13982944 | 0.77 | PIN1 (0.50) | PIN1CYP1A2CYP2C19MAPK1CASP1 | |
| SCHEMBL4607219 | 0.75 | ERCC1 (0.56) | PIN1CYP1A2CYP2C19MAPK1CASP1 | |
| SCHEMBL11852911 | 0.74 | DHODH (0.51) | DHODHCHEK2PIN1MEN1KMT2A | |
| SCHEMBL10552657 | 0.74 | PKM (0.50) | CHEK2CYP1A2CYP2C19KDM4EMEN1 | |
| SCHEMBL3760324 | 0.73 | KDM4E (0.73) | PIN1CYP1A2CYP2C19MAPK1CASP1 | |
| SCHEMBL30903772 | 0.73 | MAPK13 (0.65) | DHODHCHEK2MEN1GAAKMT2A | |
| SCHEMBL504576 | 0.73 | DHODH (0.68) | DHODHCHEK2 |
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-2952513-B1 | AZOLE BENZENE DERIVATIVE | TEIJIN PHARMA LTD (JP) | 2019-07-10 | — | — | EP | disclosed |