Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PPM1B | O75688 | 1/20 | 0.30 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | PPP1CC | P36873 | 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 | |
|---|---|---|---|---|
| SCHEMBL20221265 | 0.89 | HRH3 (0.35) | ATML3MBTL1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL24411446 | 0.80 | — | — | |
| SCHEMBL18983664 | 0.76 | GRM4 (0.31) | CYP1A2CYP2C9TSHRCYP2C19 | |
| SCHEMBL3814740 | 0.76 | ALDH1A1 (0.44) | ATML3MBTL1CYP1A2CYP2C9TSHR | |
| SCHEMBL30243856 | 0.75 | KMT2A (0.31) | — | |
| Hydrochloric Acid SCHEMBL6010553 | 0.75 | ALDH1A1 (0.43) | ATML3MBTL1CYP1A2CYP2C9TSHR | |
| SCHEMBL16391368 | 0.73 | MMP2 (0.37) | ATML3MBTL1CYP2C19 | |
| SCHEMBL31649354 | 0.72 | EPHX2 (0.36) | ATML3MBTL1CYP1A2CYP2C9TSHR | |
| SCHEMBL16984972 | 0.72 | HRH3 (0.41) | ATML3MBTL1CYP1A2CYP2C9TSHR | |
| SCHEMBL26046565 | 0.72 | HRH3 (0.41) | ATML3MBTL1CYP1A2CYP2C9TSHR |
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-2023141852-A1 | CDK2 INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF | 益方生物科技(上海)股份有限公司 | 2023-08-03 | — | — | WO | disclosed |