Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 9/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | SCN4A | P35499 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | JMJD6 | Q6NYC1 | 2/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.33 |
| ▸ | USP1 | O94782 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17440142 | 0.81 | CHRM1 (0.44) | CHRM1CYP19A1KEAP1KMT2AMKNK1 | |
| SCHEMBL21235116 | 0.79 | CHRM1 (0.41) | CHRM1CYP19A1KEAP1KMT2ASCN4A | |
| SCHEMBL18725460 | 0.78 | CHRM1 (0.44) | CHRM1CYP19A1KMT2AJMJD6PDE2A | |
| SCHEMBL17443025 | 0.78 | JMJD6 (0.47) | CHRM1CYP19A1KMT2AMAPTJMJD6 | |
| SCHEMBL18756173 | 0.77 | CHRM1 (0.39) | CHRM1CYP19A1KEAP1KMT2ASCN4A | |
| SCHEMBL18725427 | 0.74 | CHRM1 (0.59) | CHRM1PDE2APDE11A | |
| SCHEMBL18725352 | 0.74 | CHRM1 (0.59) | CHRM1PDE2APDE11A | |
| SCHEMBL18725429 | 0.72 | CHRM1 (0.43) | CHRM1PDE2APDE11A | |
| SCHEMBL18725497 | 0.72 | CHRM1 (0.57) | CHRM1PDE2APDE11A | |
| SCHEMBL18725380 | 0.72 | CHRM1 (0.48) | CHRM1PDE2APDE11A |
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 |