Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN5A | Q14524 | 4/20 | 0.39 |
| ▸ | SERPINE1 | P05121 | 2/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.37 |
| ▸ | ACP1 | P24666 | 1/20 | 0.36 |
| ▸ | NPM1 | P06748 | 1/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.36 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.34 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.34 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13717480 | 0.77 | AURKA (0.52) | SERPINE1ALDH1A1MCHR1NPBWR1CHRM5 | |
| SCHEMBL13717308 | 0.76 | TDP2 (0.45) | SCN5APIM1PIM2ALDH1A1MCHR1 | |
| SCHEMBL13717929 | 0.75 | AURKA (0.44) | SCN5ASERPINE1MCHR1NPBWR1 | |
| SCHEMBL10511571 | 0.74 | NPC1 (0.44) | ALDH1A1 | |
| SCHEMBL10507649 | 0.74 | NPC1 (0.44) | ALDH1A1 | |
| SCHEMBL13717796 | 0.72 | SCN5A (0.48) | SCN5ASERPINE1PIM1PIM2ALDH1A1 | |
| SCHEMBL13717441 | 0.72 | MCHR1 (0.47) | SCN5ASERPINE1PIM1PIM2ALDH1A1 | |
| SCHEMBL13838794 | 0.71 | NPBWR1 (0.50) | SCN5ASERPINE1PIM1PIM2MCHR1 | |
| SCHEMBL13717668 | 0.70 | MCHR1 (0.44) | SCN5ASERPINE1PIM1PIM2ALDH1A1 | |
| SCHEMBL5310315 | 0.70 | CHEK1 (0.52) | SCN5ACHRM5TRPV1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103649056-B | Fused heterocyclic compounds as modulators of ion channels | GILEAD SCIENCES, INC. (US) | 2016-04-27 | — | — | CN | disclosed |