Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2950902 | 0.85 | CYP3A4 (0.37) | CYP3A4KCNH2CYP2C9CYP2C19 | |
| SCHEMBL3913666 | 0.84 | KCNH2 (0.35) | CYP3A4KCNH2CYP2C9CYP2C19 | |
| SCHEMBL2945296 | 0.84 | CYP3A4 (0.37) | CYP3A4KCNH2 | |
| SCHEMBL2942807 | 0.84 | KCNH2 (0.35) | CYP3A4KCNH2 | |
| SCHEMBL2950737 | 0.84 | DGAT2 (0.41) | — | |
| SCHEMBL4605798 | 0.83 | CYP3A4 (0.36) | CYP3A4KCNH2CYP2C9CYP2C19 | |
| SCHEMBL2949608 | 0.82 | CYP3A4 (0.36) | CYP3A4KCNH2CYP2C9CYP2C19 | |
| SCHEMBL2950724 | 0.81 | CYP3A4 (0.38) | CYP3A4KCNH2CYP2C9CYP2C19 | |
| SCHEMBL2944695 | 0.81 | CYP3A4 (0.38) | CYP3A4KCNH2CYP2C9CYP2C19 | |
| SCHEMBL2951433 | 0.81 | CYP3A4 (0.36) | CYP3A4KCNH2CYP2C9CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1940782-A1 | N-PHENYL PHENYLACETAMIDE NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INIHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2008-07-09 | — | — | EP | claimed |
| WO-2007045572-A1 | N-PHENYL PHENYLACETAMIDE NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INIHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-04-26 | — | — | WO | claimed |