Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 3/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.47 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.47 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.47 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.47 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.47 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.47 |
| ▸ | CYP4F8 | P98187 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL19857042 | 0.86 | PDE4A (0.45) | CYP1A2DYRK1APDE4BPDE4APDE4C | |
| SCHEMBL16824800 | 0.85 | PDE4A (0.48) | CYP1A2DYRK1APDE4BPDE4APDE4C | |
| SCHEMBL19857039 | 0.80 | SCN5A (0.46) | CTSADYRK1APDE4BPDE4APDE4C | |
| SCHEMBL16821802 | 0.79 | CTSA (0.42) | CTSACYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL19857041 | 0.75 | PPARD (0.45) | CTSADYRK1APDE4BPDE4APDE4C | |
| SCHEMBL16824807 | 0.74 | FFAR4 (0.47) | CYP1A2PPARD | |
| SCHEMBL19857040 | 0.71 | PDE4A (0.46) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL19857045 | 0.71 | PPARD (0.46) | SYKPPARD | |
| SCHEMBL6345043 | 0.71 | CRHR1 (0.62) | CTSACYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL16821869 | 0.70 | SYK (0.41) | SYKMEN1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3092234-B1 | FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS | GILEAD SCIENCES INC (US) | 2018-02-14 | — | — | EP | disclosed |