Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.36 |
| ▸ | TIPARP | Q7Z3E1 | 12/20 | 0.35 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.31 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.30 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 2/20 | 0.30 |
| ▸ | KDM4C | Q9H3R0 | 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 | |
|---|---|---|---|---|
| SCHEMBL24640646 | 0.85 | SOS1 (0.37) | TIPARPPARP2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL24640655 | 0.85 | SOS1 (0.37) | TIPARPPARP2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL24640827 | 0.81 | NLRP3 (0.42) | NLRP3TIPARPPARP2CYP2D6CYP2C9 | |
| SCHEMBL31245120 | 0.78 | HTR2A (0.39) | — | |
| SCHEMBL24639245 | 0.78 | NLRP3 (0.40) | NLRP3TIPARPPARP2CYP2D6CYP2C9 | |
| SCHEMBL24639251 | 0.78 | NLRP3 (0.41) | NLRP3TIPARPPARP2CYP2D6CYP2C9 | |
| SCHEMBL24640834 | 0.76 | NLRP3 (0.34) | NLRP3TIPARPPARP2CYP2C9CYP2C19 | |
| SCHEMBL24639258 | 0.74 | TIPARP (0.33) | TIPARP | |
| SCHEMBL24639264 | 0.74 | TIPARP (0.33) | TIPARP | |
| SCHEMBL24639285 | 0.74 | TIPARP (0.33) | TIPARP |
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-2022170974-A1 | TRICYCLIC DERIVATIVES USEFUL AS PARP7 INHIBITORS | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2022-08-18 | — | — | WO | disclosed |