Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.30 |
| ▸ | GPR183 | P32249 | 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 | |
|---|---|---|---|---|
| SCHEMBL13187699 | 0.73 | HPGD (0.47) | KDM4EADORA3HSD17B10ALDH1A1 | |
| SCHEMBL28798580 | 0.66 | KDM4E (0.46) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL13406334 | 0.63 | ALDH1A1 (0.43) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL14281554 | 0.61 | ADORA3 (0.45) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19760867 | 0.61 | POLB (0.47) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL18643546 | 0.60 | TYMS (0.43) | PARP1KDM4ELMNAHSD17B10ALDH1A1 | |
| SCHEMBL10826305 | 0.60 | ALDH1A1 (0.41) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL8278866 | 0.60 | PARP1 (0.46) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL14337027 | 0.59 | PARP1 (0.50) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL8058002 | 0.59 | ALDH1A1 (0.54) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 |
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-2022161461-A1 | SOS1 INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 江苏先声药业有限公司 | 2022-08-04 | — | — | WO | disclosed |