Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 2/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP4 | P49662 | 1/20 | 0.36 |
| ▸ | CASP5 | P51878 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18401282 | 0.98 | CHRM5 (0.56) | CHRM5ADRA2CACHESMN1; SMN2CHRM2 | |
| SCHEMBL18401417 | 0.98 | CHRM5 (0.56) | CHRM5ADRA2CACHESMN1; SMN2CHRM2 | |
| SCHEMBL22422525 | 0.98 | CHRM5 (0.56) | CHRM5ADRA2CACHESMN1; SMN2CHRM2 | |
| SCHEMBL2616298 | 0.91 | CHRM5 (0.39) | CHRM5ADRA2CACHE | |
| SCHEMBL12772838 | 0.86 | CHRM5 (0.62) | CHRM5ADRA2CACHESMN1; SMN2CHRM2 | |
| SCHEMBL1777579 | 0.84 | CHRM5 (0.67) | CHRM5ADRA2CACHESMN1; SMN2CHRM2 | |
| SCHEMBL2616300 | 0.82 | CHRM5 (0.56) | CHRM5ADRA2CACHESMN1; SMN2CASP1 | |
| SCHEMBL22783243 | 0.79 | CHRM5 (0.48) | CHRM5ADRA2CACHESMN1; SMN2CHRM2 | |
| SCHEMBL21085341 | 0.78 | CHRM5 (0.52) | CHRM5ADRA2CACHESMN1; SMN2CHRM2 | |
| SCHEMBL25604642 | 0.78 | ACHE (0.55) | CHRM5ADRA2CACHESMN1; SMN2CASP1 |
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-3241554-B1 | QUINOLINE-8-SULFONAMIDE DERIVATIVES HAVING AN ANTICANCER ACTIVITY | AGIOS PHARMACEUTICALS INC (US) | 2020-01-29 | — | — | EP | disclosed |