Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | PRCP | P42785 | 10/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13087949 | 0.95 | CYP3A4 (0.47) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL1293998 | 0.92 | PRCP (0.45) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL1294000 | 0.92 | PRCP (0.45) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL1293995 | 0.92 | PRCP (0.45) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL1293589 | 0.89 | PRCP (0.45) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL1293593 | 0.89 | PRCP (0.45) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL14816917 | 0.89 | CYP3A4 (0.42) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL12295067 | 0.89 | CYP3A4 (0.42) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL17277688 | 0.89 | CYP3A4 (0.42) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 | |
| SCHEMBL16001548 | 0.88 | HPGDS (0.49) | HPGDSCYP3A4CYP2C9NR1I2ABCB11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013021344-A1 | IMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS | LUPIN LIMITED (IN) | 2013-02-14 | — | — | WO | disclosed |