Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.58 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.58 |
| ▸ | DRD1 | P21728 | 3/20 | 0.58 |
| ▸ | DRD3 | P35462 | 3/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.58 |
| ▸ | HTR1A | P08908 | 2/20 | 0.58 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.58 |
| ▸ | BCL2 | P10415 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL12503222 | 0.86 | CYP2D6 (0.47) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| SCHEMBL324172 | 0.84 | CYP2D6 (0.67) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| SCHEMBL327686 | 0.84 | CYP2D6 (0.43) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| SCHEMBL325002 | 0.83 | ALDH1A1 (0.47) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| SCHEMBL323776 | 0.83 | CYP3A4 (0.61) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| SCHEMBL325153 | 0.82 | CYP3A4 (0.48) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| SCHEMBL2056217 | 0.80 | CHRM2 (0.86) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| SCHEMBL324763 | 0.79 | CYP3A4 (0.45) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| Chlorcyclizine SCHEMBL13724147 | 0.74 | KCNH2 (1.00) | CHRM2ADRA2ACHRM1DRD1DRD3 | |
| Chlorcyclizine SCHEMBL12157065 | 0.74 | KCNH2 (1.00) | CHRM2ADRA2ACHRM1DRD1DRD3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2590953-A1 | TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | Convergence Pharmaceuticals Limited (GB) | 2013-05-15 | — | — | EP | claimed |
| WO-2012004604-A1 | TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | Convergence Pharmaceuticals Limited (GB) | 2012-01-12 | — | — | WO | claimed |
| EP-2590953-A1 | TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | Convergence Pharmaceuticals Limited (GB) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012004604-A1 | TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | Convergence Pharmaceuticals Limited (GB) | 2012-01-12 | — | — | WO | disclosed |