Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | EPAS1 | Q99814 | 3/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.38 |
| ▸ | VEGFA | P15692 | 1/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 6/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | GPR183 | P32249 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5374410 | 0.87 | CYP3A4 (0.49) | CYP3A4EPAS1FNTAFNTBPGGT1B | |
| SCHEMBL5366909 | 0.86 | CYP3A4 (0.46) | CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL5374482 | 0.85 | CYP3A4 (0.61) | CYP3A4EPAS1FNTAFNTBPGGT1B | |
| SCHEMBL5377579 | 0.85 | CYP3A4 (0.52) | CYP3A4EPAS1FNTAFNTBPGGT1B | |
| SCHEMBL5375295 | 0.85 | CYP3A4 (0.47) | CYP3A4EPAS1FNTAFNTBPGGT1B | |
| SCHEMBL5370328 | 0.85 | CYP3A4 (0.47) | CYP3A4EPAS1FNTAFNTBPGGT1B | |
| SCHEMBL5370543 | 0.84 | CYP3A4 (0.46) | CYP3A4EPAS1FNTAFNTBPGGT1B | |
| SCHEMBL5375034 | 0.84 | CYP3A4 (0.37) | CYP3A4ARCYP2C9CYP2C19KCNH2 | |
| SCHEMBL5368699 | 0.82 | AR (0.39) | CYP3A4PRMT5WDR77AR | |
| SCHEMBL5377568 | 0.80 | CYP3A4 (0.47) | CYP3A4ARCYP2C9CYP2C19KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |