Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | CCNC | P24863 | 1/20 | 0.48 |
| ▸ | CDK8 | P49336 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | LCAT | P04180 | 2/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22499863 | 1.00 | HRH3 (0.48) | HRH3CCNCCDK8CYP3A4CHRM4 | |
| SCHEMBL22499830 | 0.86 | SLC6A9 (0.41) | HRH3CHRM4PPARDPPARANOTUM | |
| SCHEMBL22499829 | 0.86 | SLC6A9 (0.41) | HRH3CHRM4PPARDPPARANOTUM | |
| SCHEMBL16398200 | 0.85 | MCHR1 (0.40) | CCNCCDK8NOTUMMCHR1 | |
| SCHEMBL22499979 | 0.84 | ACACB (0.48) | HRH3CHRM4NOTUMCHRM2 | |
| SCHEMBL22499980 | 0.84 | ACACB (0.48) | HRH3CHRM4NOTUMCHRM2 | |
| SCHEMBL16398478 | 0.83 | MAPT (0.51) | MCHR1 | |
| SCHEMBL16398474 | 0.83 | MAPT (0.51) | MCHR1 | |
| SCHEMBL1261496 | 0.83 | NOTUM (0.60) | CYP3A4CHRM4PPARDPPARANOTUM | |
| SCHEMBL22499825 | 0.81 | SLC6A9 (0.43) | HRH3LCAT |
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-2020203610-A1 | USE OF T-TYPE CALCIUM CHANNEL BLOCKER FOR TREATING RHEUMATOID ARTHRITIS | 日本ケミファ株式会社 | 2020-10-08 | — | — | WO | disclosed |