Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | PRCP | P42785 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | F11 | P03951 | 2/20 | 0.36 |
| ▸ | F2 | P00734 | 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 | |
|---|---|---|---|---|
| SCHEMBL12159986 | 0.94 | CYP3A4 (0.46) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL12160023 | 0.94 | CYP3A4 (0.46) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL203943 | 0.90 | HPGDS (0.44) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL12160033 | 0.90 | HPGDS (0.44) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL2708053 | 0.90 | HPGDS (0.44) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL19323292 | 0.90 | HPGDS (0.44) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL13337614 | 0.87 | CYP3A4 (0.54) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL14793107 | 0.84 | CYP2C9 (0.48) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL12530978 | 0.84 | CYP2C9 (0.48) | HPGDSCYP3A4CYP2C9KCNH2NR1I2 | |
| SCHEMBL31413859 | 0.84 | VHL (0.49) | — |
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-2012068234-A2 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2012-05-24 | — | — | WO | disclosed |