Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 6/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | EP300 | Q09472 | 1/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL18756168 | 0.84 | CHRM1 (0.45) | CHRM1KEAP1PARP1MKNK1MKNK2 | |
| SCHEMBL18725424 | 0.80 | CHRM1 (0.70) | CHRM1 | |
| SCHEMBL18725451 | 0.78 | CHRM1 (0.63) | CHRM1 | |
| SCHEMBL18725437 | 0.77 | CHRM1 (0.46) | CHRM1KEAP1MKNK1MKNK2KMT2A | |
| SCHEMBL18756158 | 0.76 | CHRM1 (0.48) | CHRM1 | |
| SCHEMBL21235159 | 0.76 | CHRM1 (0.48) | CHRM1 | |
| SCHEMBL18725454 | 0.74 | CHRM1 (0.47) | CHRM1KEAP1ALDH1A1HSD17B10KMT2A | |
| SCHEMBL18756525 | 0.73 | CHRM1 (0.44) | CHRM1KEAP1MKNK1MKNK2KMT2A | |
| SCHEMBL26966632 | 0.73 | CHRM1 (0.45) | CHRM1KEAP1MKNK1MKNK2KMT2A | |
| SCHEMBL18725526 | 0.72 | CHRM1 (0.45) | CHRM1ALDH1A1HSD17B10PARP1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3156397-B1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2019-08-07 | — | — | EP | disclosed |
| EP-3156397-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2017-04-19 | — | — | EP | disclosed |