Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP19 | O94966 | 16/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | GPR55 | Q9Y2T6 | 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 | |
|---|---|---|---|---|
| SCHEMBL20042651 | 0.82 | CHRM4 (0.52) | ADORA2AADORA1CYP1A2CHRM4NPY5R | |
| SCHEMBL20042806 | 0.80 | CNR1 (0.47) | CHRM4CNR1GPR55 | |
| SCHEMBL20042654 | 0.80 | HSD11B1 (0.41) | ADORA2AADORA1CYP1A2CHRM4CNR1 | |
| SCHEMBL20042773 | 0.80 | CHRM4 (0.52) | ADORA2AADORA1CYP1A2CHRM4NPY5R | |
| SCHEMBL20042764 | 0.79 | CNR1 (0.49) | CNR1GPR55 | |
| SCHEMBL20042834 | 0.78 | CHRM4 (0.56) | ADORA2AADORA1CYP1A2CHRM4CNR1 | |
| SCHEMBL20042714 | 0.76 | CHRM4 (0.43) | ADORA2AADORA1CYP1A2CHRM4CNR1 | |
| SCHEMBL20042816 | 0.75 | CNR1 (0.45) | CYP1A2CHRM4CNR1GPR55 | |
| SCHEMBL20042735 | 0.75 | CNR2 (0.41) | CHRM4CNR1GPR55 | |
| SCHEMBL20042706 | 0.74 | ALDH1A1 (0.43) | CHRM4CNR1GPR55 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |