Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.31 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.31 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.31 |
| ▸ | CDC25A | P30304 | 1/20 | 0.30 |
| ▸ | CDC25B | P30305 | 1/20 | 0.30 |
| ▸ | CDC25C | P30307 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21161631 | 0.87 | SYK (0.35) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL2667103 | 0.87 | SYK (0.35) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL22359799 | 0.83 | SYK (0.39) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL21375528 | 0.80 | RECQL (0.37) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL21646966 | 0.80 | RECQL (0.37) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL20158888 | 0.80 | MEN1 (0.40) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL3786037 | 0.79 | RECQL (0.35) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL19380327 | 0.79 | MEN1 (0.42) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL22143595 | 0.75 | CYP1A2 (0.39) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL3786069 | 0.73 | RECQL (0.33) | RECQLALDH1A1CYP3A4CYP2C9CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018086609-A1 | 3,4-BIPYRIDYL PYRAZOLE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND MEDICAL APPLICATION THEREOF | 江苏恒瑞医药股份有限公司 | 2018-05-17 | — | — | WO | disclosed |
| EP-2894151-A1 | IMIDAZOLINE DERIVATIVES, PREPARATION METHODS THEREOF, AND THEIR APPLICATIONS IN MEDICINE | Shanghai Hengrui Pharmaceutical Co. Ltd. (CN) | 2015-07-15 | — | — | EP | disclosed |