Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CSF1R | P07333 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.31 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.31 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.30 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | KDM5A | P29375 | 1/20 | 0.30 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1918865 | 0.73 | — | — | |
| SCHEMBL1998996 | 0.67 | KDM2B (0.34) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL1304429 | 0.63 | CYP2E1 (0.47) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL13678288 | 0.60 | CLK4 (0.51) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL18806853 | 0.60 | CYP2C9 (0.57) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL14415968 | 0.59 | TP53 (0.34) | CYP2C9CYP2C19TSHRMTORHRH4 | |
| SCHEMBL2140418 | 0.58 | CYP2C9 (0.30) | CYP2C9CYP2C19TSHRMTORHRH4 | |
| SCHEMBL16034025 | 0.58 | KDM2B (0.48) | CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL17563127 | 0.57 | GPR119 (0.41) | KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL16389765 | 0.57 | ALDH1A1 (0.36) | CYP2A6KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117881681-A | Substituted pyrrolo [2,3-d ] pyrimidines, their preparation and their therapeutic use | 赛诺菲 | 2024-04-12 | — | — | CN | disclosed |