Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.77 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.77 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.77 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.77 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.77 |
| ▸ | SLC18A2 | Q05940 | 9/20 | 0.62 |
| ▸ | HTR2A | P28223 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL21706359 | 1.00 | HTR1A (0.77) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL21706281 | 1.00 | HTR1A (0.77) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL19051987 | 0.89 | HTR1A (0.73) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL20278159 | 0.88 | HTR1A (0.83) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL22186209 | 0.88 | HTR1A (0.83) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL20411762 | 0.88 | HTR1A (0.83) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL10018919 | 0.87 | HTR1A (0.78) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL22612151 | 0.87 | HTR1A (0.70) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL19024412 | 0.87 | HTR1A (0.70) | HTR1ATBXA2RPTGS1OPRM1KCNH2 | |
| SCHEMBL22612169 | 0.87 | HTR1A (0.70) | HTR1ATBXA2RPTGS1OPRM1KCNH2 |
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-2018067945-A1 | SOLID STATE FORMS OF VALBENAZINE | ASSIA CHEMICAL INDUSTRIES LTD. (IL) | 2018-04-12 | — | — | WO | disclosed |