Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 3/20 | 0.44 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | EDNRB | P24530 | 1/20 | 0.37 |
| ▸ | EDNRA | P25101 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 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 | |
|---|---|---|---|---|
| SCHEMBL2729130 | 0.87 | CES1 (0.46) | CES1KCNN4CYP2C19HIF1ACHRM2 | |
| SCHEMBL13183609 | 0.84 | CES1 (0.43) | CES1KCNN4CYP2C19HIF1ANR1H2 | |
| SCHEMBL6529359 | 0.84 | MAPT (0.48) | CES1KCNN4CYP2C19HIF1ACHRM2 | |
| SCHEMBL10456740 | 0.82 | CES1 (0.59) | CES1KCNN4CYP2C19HIF1ACES2 | |
| SCHEMBL7979097 | 0.81 | PIN1 (0.49) | CES1KCNN4CHRM2CHRM1CHRM3 | |
| SCHEMBL2028143 | 0.80 | KCNN4 (0.43) | CES1KCNN4CYP2C19HIF1ACHRM2 | |
| SCHEMBL22418736 | 0.80 | KCNN4 (0.43) | CES1KCNN4CHRM2CHRM1CHRM3 | |
| SCHEMBL7495006 | 0.77 | KCNN4 (0.42) | CES1KCNN4CYP2C19HIF1ACHRM2 | |
| SCHEMBL6557126 | 0.74 | CES1 (0.44) | CES1KCNN4CYP2C19HIF1AKIF11 | |
| SCHEMBL17653676 | 0.74 | CYP2D6 (0.43) | CES1KCNN4CYP2C19HIF1ACHRM2 |
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-2328865-B1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2017-05-31 | — | — | EP | disclosed |