Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.55 |
| ▸ | CACNA1C | Q13936 | 6/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | CACNA1D | Q01668 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | CACNA1F | O60840 | 3/20 | 0.55 |
| ▸ | CACNA1S | Q13698 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.55 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.55 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.55 |
| ▸ | SCN1A | P35498 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL11123762 | 0.93 | CACNA1D (0.51) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL11122084 | 0.91 | CACNA1D (0.59) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL11119301 | 0.91 | LMNA (0.49) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL6427366 | 0.90 | CACNA1D (0.57) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL6427770 | 0.89 | ADORA3 (0.67) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL11117647 | 0.89 | CACNA1D (0.56) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL6425245 | 0.89 | CACNA1D (0.61) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL10647241 | 0.88 | CACNA1C (0.53) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL10528018 | 0.88 | CACNA1D (0.55) | ADORA3CACNA1CCYP1A2MAPTCACNA1D | |
| SCHEMBL11586935 | 0.87 | CACNA1C (0.54) | ADORA3CACNA1CCYP1A2MAPTCACNA1D |
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-0110259-A1 | 1,4-Dihydropyridines, processes for their preparation and their use in medicines | BAYER AG (DE) | 1984-06-13 | — | — | EP | disclosed |