Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | PRCP | P42785 | 6/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | GCK | P35557 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1759015 | 0.87 | PRCP (0.40) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 | |
| SCHEMBL571726 | 0.85 | CYP3A4 (0.50) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 | |
| SCHEMBL14966582 | 0.83 | CYP3A4 (0.49) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 | |
| SCHEMBL3389376 | 0.82 | PRCP (0.45) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 | |
| SCHEMBL1758861 | 0.82 | L3MBTL1 (0.35) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 | |
| SCHEMBL45250 | 0.81 | UCHL1 (0.44) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 | |
| SCHEMBL45280 | 0.81 | UCHL1 (0.44) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 | |
| SCHEMBL2711186 | 0.81 | UCHL1 (0.44) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 | |
| SCHEMBL8749971 | 0.80 | PREP (0.50) | L3MBTL1 | |
| SCHEMBL23247493 | 0.77 | UCHL1 (0.41) | CYP3A4CYP2C9KCNH2NR1I2ABCB11 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2850085-A1 | ANTIVIRAL COMPOUNDS INHIBITORS OF HCV NS5B | Gilead Pharmasset LLC (US) | 2015-03-25 | — | — | EP | disclosed |
| WO-2013173488-A1 | ANTIVIRAL COMPOUNDS INHIBITORS OF HCV NS5B | GILEAD SCIENCES, INC. (US) | 2013-11-21 | — | — | WO | disclosed |
| EP-2640719-A2 | ANTIVIRAL COMPOUNDS | Gilead Sciences, Inc. (US) | 2013-09-25 | — | — | EP | disclosed |
| WO-2013052369-A1 | NOVEL BENZIMIDAZOLE DERIVATIVES | ENANTA PHARMACEUTICALS, INC. (US) | 2013-04-11 | — | — | WO | disclosed |
| WO-2012068234-A2 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2012-05-24 | — | — | WO | disclosed |
| EP-2430014-A1 | ANTIVIRAL COMPOUNDS | Gilead Sciences, Inc. (US) | 2012-03-21 | — | — | EP | disclosed |
| WO-2010132601-A1 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2010-11-18 | — | — | WO | disclosed |