Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.53 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4560161 | 1.00 | KCNH2 (0.53) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4560162 | 1.00 | KCNH2 (0.53) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4560160 | 1.00 | KCNH2 (0.53) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL4559542 | 0.99 | KCNH2 (0.53) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL4559543 | 0.99 | KCNH2 (0.53) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL4559540 | 0.99 | KCNH2 (0.53) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4513674 | 0.90 | KCNH2 (0.52) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4513669 | 0.90 | KCNH2 (0.52) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4511192 | 0.90 | KCNH2 (0.65) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4511185 | 0.90 | KCNH2 (0.65) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1255739-B1 | 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS | WARNER LAMBERT CO (US) | 2008-06-11 | — | — | EP | claimed |