Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.66 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.66 |
| ▸ | TBXA2R | P21731 | 3/20 | 0.66 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.66 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.66 |
| ▸ | TSHR | P16473 | 2/20 | 0.66 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.66 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.66 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.66 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.66 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL11451713 | 0.92 | CYP2C9 (0.61) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL7407254 | 0.89 | CYP2C9 (0.83) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL7275334 | 0.88 | CYP2C9 (0.70) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL7410229 | 0.85 | CYP2C9 (0.66) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL8084216 | 0.83 | CYP2C9 (0.64) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL7479783 | 0.83 | CYP2C9 (0.72) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL10410004 | 0.83 | CYP2C9 (0.72) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL3032376 | 0.83 | CYP2C9 (0.61) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL11451831 | 0.82 | CYP2C9 (0.62) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 | |
| SCHEMBL11497442 | 0.82 | CYP2C9 (0.62) | CYP2C9ABCB11TBXA2RADRA1ASLC6A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4264611-A | HYPOTENSIVE AGENTS | AKTIEBOLAGET HASSLE (SE) | 1981-04-28 | — | — | US | claimed |
| EP-0007293-A1 | 2,6-Dimethyl-4-(2,3-dichlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid-3-methyl ester-5-ethyl ester having hypotensive properties, process for its preparation and pharmaceutical preparations containing it | Aktiebolaget Hässle (SE) | 1980-01-23 | — | — | EP | claimed |
| EP-0007293-A1 | 2,6-Dimethyl-4-(2,3-dichlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid-3-methyl ester-5-ethyl ester having hypotensive properties, process for its preparation and pharmaceutical preparations containing it | Aktiebolaget Hässle (SE) | 1980-01-23 | — | — | EP | disclosed |