Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1C | Q14123 | 1/20 | 0.47 |
| ▸ | CACNA1C | Q13936 | 7/20 | 0.43 |
| ▸ | CACNA1F | O60840 | 6/20 | 0.43 |
| ▸ | CACNA1D | Q01668 | 6/20 | 0.43 |
| ▸ | CACNA1S | Q13698 | 6/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 6/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.42 |
| ▸ | LMNA | P02545 | 6/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.42 |
| ▸ | THPO | P40225 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7271902 | 0.93 | PDE1C (0.48) | PDE1CCACNA1CCACNA1FCACNA1DCACNA1S | |
| SCHEMBL7273075 | 0.90 | PDE1C (0.49) | PDE1CCACNA1CCACNA1FCACNA1DCACNA1S | |
| SCHEMBL10998264 | 0.90 | PDE1C (0.57) | PDE1CCACNA1CCACNA1FCACNA1DCACNA1S | |
| SCHEMBL7273206 | 0.89 | PDE1C (0.46) | PDE1CCACNA1CCACNA1FCACNA1DCACNA1S | |
| SCHEMBL10368720 | 0.84 | CYP1A2 (0.46) | PDE1CCACNA1CADORA3MEN1KMT2A | |
| SCHEMBL10366475 | 0.83 | CYP1A2 (0.52) | PDE1CCACNA1CCACNA1FCACNA1DCACNA1S | |
| SCHEMBL10366192 | 0.83 | LMNA (0.47) | PDE1CCACNA1CCACNA1FCACNA1DCACNA1S | |
| SCHEMBL10998252 | 0.83 | MAPT (0.57) | PDE1CCACNA1CADORA3MEN1KMT2A | |
| SCHEMBL10375090 | 0.82 | CYP1A2 (0.46) | PDE1CCACNA1CCACNA1FCACNA1DCACNA1S | |
| SCHEMBL10369061 | 0.82 | CYP1A2 (0.42) | PDE1CCACNA1CCACNA1FCACNA1DCACNA1S |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0116708-A1 | Substituted 1,4-dihydropyridines, method for their preparation and their use as pharmaceuticals | CASSELLA Aktiengesellschaft (DE) | 1984-08-29 | — | — | EP | disclosed |