Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 2/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.53 |
| ▸ | DRD1 | P21728 | 2/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.53 |
| ▸ | DRD3 | P35462 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.53 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL1444158 | 0.81 | LMNA (0.52) | KCNH2CYP2D6KMT2AMEN1ALDH1A1 | |
| SCHEMBL7444399 | 0.80 | CYP2D6 (0.53) | CHRM2ADRA2ACHRM1DRD1OPRM1 | |
| SCHEMBL7448448 | 0.80 | L3MBTL3 (0.54) | CHRM2ADRA2ACHRM1DRD1OPRM1 | |
| SCHEMBL7440573 | 0.79 | ALDH1A1 (0.56) | CHRM2ADRA2ACHRM1DRD1OPRM1 | |
| SCHEMBL8186671 | 0.79 | OPRM1 (0.78) | CHRM2ADRA2ACHRM1DRD1OPRM1 | |
| SCHEMBL7977689 | 0.79 | OPRM1 (0.78) | CHRM2ADRA2ACHRM1DRD1OPRM1 | |
| SCHEMBL8175607 | 0.79 | OPRM1 (0.78) | CHRM2ADRA2ACHRM1DRD1OPRM1 | |
| SCHEMBL3919536 | 0.79 | OPRM1 (0.78) | CHRM2ADRA2ACHRM1DRD1OPRM1 | |
| SCHEMBL7442471 | 0.79 | CYP2D6 (0.55) | CHRM2ADRA2ACHRM1DRD1OPRM1 | |
| SCHEMBL14095313 | 0.78 | CHRM2 (0.77) | CHRM2ADRA2ACHRM1DRD1OPRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4766213-A | 1,4-dihydropyridines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-08-23 | — | — | US | disclosed |
| EP-0237695-A2 | 1,4-Dihydropyridines | MERCK PATENT GmbH (DE) | 1987-09-23 | — | — | EP | disclosed |