Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1D | Q01668 | 7/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 6/20 | 0.41 |
| ▸ | CACNA1F | O60840 | 5/20 | 0.41 |
| ▸ | CACNA1S | Q13698 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.40 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.40 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | SCN1A | P35498 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.40 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8949578 | 0.86 | CACNA1C (0.42) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL9284454 | 0.84 | CYP1A2 (0.53) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL11279053 | 0.83 | CACNA1D (0.53) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL11498482 | 0.82 | CACNA1D (0.57) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL11498577 | 0.82 | CACNA1D (0.49) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL10913858 | 0.81 | MEN1 (0.57) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL11276232 | 0.80 | TSHR (0.39) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL10913589 | 0.80 | CACNA1D (0.51) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL11280776 | 0.79 | CACNA1B (0.44) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 | |
| SCHEMBL11119301 | 0.79 | LMNA (0.49) | CACNA1DCACNA1CCACNA1FCACNA1SCYP1A2 |
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-0595164-B1 | 4-heterocyclephenyl substituted dihydropyridines | BAYER AG (DE) | 1996-12-27 | — | — | EP | disclosed |
| EP-0595164-A1 | 4-heterocyclephenyl substituted dihydropyridines | BAYER AG (DE) | 1994-05-04 | — | — | EP | disclosed |