Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | FAAH | O00519 | 7/20 | 0.44 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.42 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.38 |
| ▸ | TERT | O14746 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5374289 | 0.94 | CYP3A4 (0.64) | CYP3A4FAAHPRMT5WDR77 | |
| SCHEMBL5367047 | 0.90 | CYP3A4 (0.54) | CYP3A4FAAH | |
| SCHEMBL5377193 | 0.87 | CYP3A4 (0.50) | CYP3A4FAAH | |
| SCHEMBL5377053 | 0.86 | CYP3A4 (0.51) | CYP3A4FAAHFDFT1ADAMTS5THRA | |
| SCHEMBL5372571 | 0.85 | CYP3A4 (0.60) | CYP3A4FAAHPRMT5WDR77 | |
| SCHEMBL5375418 | 0.85 | CYP3A4 (0.60) | CYP3A4FAAHPRMT5WDR77THRA | |
| SCHEMBL5373999 | 0.84 | CYP3A4 (0.48) | CYP3A4FAAHFDFT1THRATHRB | |
| SCHEMBL5375921 | 0.84 | CYP3A4 (0.48) | CYP3A4FAAHTHRATHRB | |
| SCHEMBL5374014 | 0.84 | CYP3A4 (0.48) | CYP3A4FAAHTHRATHRB | |
| SCHEMBL5369070 | 0.84 | CYP3A4 (0.47) | CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7189718-B2 | Non-nucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2007-03-13 | — | — | US | disclosed |
| US-7189718-B2 | Non-nucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2007-03-13 | — | — | US | disclosed |
| US-7189718-B2 | Non-nucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2007-03-13 | — | — | US | disclosed |