Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 3/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 10/20 | 0.35 |
| ▸ | ACACB | O00763 | 4/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | ACACA | Q13085 | 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 | |
|---|---|---|---|---|
| SCHEMBL17897244 | 0.85 | CHRM4 (0.41) | CHRM4CHRM1CHRM2CHRM5TRPV1 | |
| SCHEMBL18948508 | 0.80 | CHRM4 (0.43) | CHRM4CHRM1CHRM2CHRM5TRPV1 | |
| SCHEMBL15857988 | 0.78 | CHRM4 (0.43) | CHRM4CHRM1CHRM2CHRM5TRPV1 | |
| SCHEMBL19003542 | 0.77 | CHRM4 (0.43) | CHRM4CHRM1CHRM2CHRM5TRPV1 | |
| SCHEMBL19003515 | 0.74 | MAPT (0.39) | CHRM4 | |
| SCHEMBL6927953 | 0.70 | HTT (0.51) | — | |
| SCHEMBL18334275 | 0.68 | SMN1; SMN2 (0.53) | — | |
| SCHEMBL18334112 | 0.67 | HRH4 (0.41) | TRPV1 | |
| SCHEMBL21135462 | 0.64 | PTGS1 (0.47) | CHRM4CHRM1CHRM2CHRM5 | |
| SCHEMBL17897237 | 0.62 | GRM1 (0.52) | CHRM4CHRM1 |
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-2938344-B1 | PIPERAZINE-SUBSTITUTED [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES | MERCK SHARP & DOHME (US) | 2017-06-21 | — | — | EP | disclosed |