Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1C | Q13936 | 6/20 | 0.60 |
| ▸ | CACNA1D | Q01668 | 6/20 | 0.57 |
| ▸ | CACNA1F | O60840 | 4/20 | 0.57 |
| ▸ | CACNA1S | Q13698 | 4/20 | 0.57 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.57 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.57 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.57 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.57 |
| ▸ | SCN1A | P35498 | 2/20 | 0.57 |
| ▸ | HTR2B | P41595 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.57 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.57 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.57 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.57 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL7379595 | 0.88 | CACNA1C (0.64) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL7417439 | 0.87 | CACNA1C (0.61) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL6586819 | 0.87 | CACNA1C (0.63) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL7464515 | 0.86 | CACNA1C (0.60) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL1617472 | 0.85 | CACNA1C (0.77) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL29810716 | 0.85 | CACNA1C (0.77) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL7529154 | 0.84 | CACNA1C (0.57) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL7385492 | 0.83 | CACNA1C (0.58) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL7531629 | 0.83 | CACNA1C (0.56) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 | |
| SCHEMBL10386056 | 0.83 | CACNA1C (0.60) | CACNA1CCACNA1DCACNA1FCACNA1SADORA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0233228-A1 | PHARMACEUTICALLY ACTIVE 2-THIOMETHYL-SUBSTITUTED-1,4-DIHYDROPYRIDINES | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1987-08-26 | — | — | EP | disclosed |
| WO-1987000836-A1 | PHARMACEUTICALLY ACTIVE 2-THIOMETHYL-SUBSTITUTED-1,4-DIHYDROPYRIDINES | BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) | 1987-02-12 | — | — | WO | disclosed |