Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ATP4A | P20648 | 2/20 | 0.34 |
| ▸ | ATP4B | P51164 | 2/20 | 0.34 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.34 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | FASN | P49327 | 1/20 | 0.34 |
| ▸ | SLC47A2 | Q86VL8 | 1/20 | 0.34 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9544128 | 0.97 | CYP2C9 (0.41) | CYP2C9ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL9382421 | 0.92 | CYP2C9 (0.41) | CYP2C9ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL9541742 | 0.92 | CYP2C9 (0.36) | CYP2C9ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL9541724 | 0.89 | CYP2C9 (0.41) | CYP2C9ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL9542909 | 0.89 | CYP2C9 (0.36) | CYP2C9ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL9286732 | 0.89 | CYP2C9 (0.38) | CYP2C9ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL9232111 | 0.86 | CYP2C9 (0.40) | CYP2C9MAPTHPGDLMNAPTK2 | |
| SCHEMBL9232103 | 0.86 | CYP2C9 (0.40) | CYP2C9ALDH1A1MAPTHPGDCTSD | |
| SCHEMBL6474993 | 0.85 | CYP2C9 (0.38) | CYP2C9ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL9227319 | 0.85 | CYP2C9 (0.36) | CYP2C9ALDH1A1KDM4EMAPTHPGD |
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-1993012124-A1 | SUBSTITUTED BENZIMIDAZOLES, PROCESS FOR THEIR PREPARATION AS WELL AS THEIR USE | AB ASTRA (SE) | 1993-06-24 | — | — | WO | disclosed |