Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20980172 | 0.87 | HRH3 (0.43) | HRH3CCR2KCNH2CHRM2HTR1A | |
| SCHEMBL24700866 | 0.86 | HRH3 (0.47) | HRH3CCR2KCNH2CHRM2HTR1A | |
| SCHEMBL22893242 | 0.86 | HRH3 (0.47) | HRH3CCR2KCNH2CHRM2HTR1A | |
| SCHEMBL26194411 | 0.84 | HRH3 (0.46) | HRH3CCR2KCNH2CHRM2HTR1A | |
| SCHEMBL21745490 | 0.84 | HRH3 (0.44) | HRH3CCR2KCNH2 | |
| SCHEMBL21157892 | 0.83 | HRH3 (0.45) | HRH3CCR2KCNH2CHRM2HTR1A | |
| SCHEMBL18898331 | 0.82 | HRH3 (0.40) | HRH3CCR2KCNH2 | |
| SCHEMBL25872792 | 0.82 | HRH3 (0.44) | HRH3CCR2KCNH2CHRM2HTR1A | |
| SCHEMBL23920781 | 0.81 | HRH3 (0.43) | HRH3CCR2KCNH2CHRM2HTR1A | |
| SCHEMBL25829852 | 0.81 | HRH3 (0.44) | HRH3CCR2KCNH2CHRM2HTR1A |
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-2022036080-A1 | CONDENSED AZACYCLES AS SIGMA LIGAND COMPOUNDS AND USES THEREOF | MINERVA NEUROSCIENCES, INC. (US) | 2022-02-17 | — | — | WO | disclosed |