Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.80 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.80 |
| ▸ | MAPT | P10636 | 7/20 | 0.80 |
| ▸ | CACNA1C | Q13936 | 6/20 | 0.80 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.80 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.80 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.80 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.80 |
| ▸ | LMNA | P02545 | 4/20 | 0.80 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.80 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.80 |
| ▸ | TSHR | P16473 | 4/20 | 0.80 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.80 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.80 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.80 |
| ▸ | HTR2B | P41595 | 3/20 | 0.80 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.80 |
| ▸ | DRD1 | P21728 | 3/20 | 0.80 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.80 |
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 | |
|---|---|---|---|---|
| SCHEMBL7486022 | 0.96 | CACNA1D (0.72) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| Hydrochloric Acid SCHEMBL7486013 | 0.94 | CACNA1D (0.70) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| SCHEMBL9672835 | 0.94 | ADORA3 (0.77) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| SCHEMBL9673716 | 0.93 | CACNA1C (0.76) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| SCHEMBL11824944 | 0.92 | CYP1A2 (0.82) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| SCHEMBL9674077 | 0.92 | CACNA1C (0.74) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| SCHEMBL7158381 | 0.91 | ADORA3 (0.80) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| SCHEMBL9175041 | 0.91 | ADORA3 (0.80) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| SCHEMBL7282364 | 0.90 | CYP1A2 (0.79) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 | |
| SCHEMBL5085498 | 0.90 | ADORA3 (0.86) | ADORA3CYP1A2MAPTCACNA1CCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0250725-B1 | 1,4-DIHYDROPYRIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | HEUMANN PHARMA GMBH & CO (DE) | 1992-11-04 | — | — | EP | disclosed |
| US-4757080-A | Pharmaceuticals | HEUMANN PHARMA GMBH & CO. (DE) | 1988-07-12 | — | — | US | disclosed |
| EP-0250725-A1 | 1,4-Dihydropyridine derivatives, processes for their preparation and medicaments containing them | HEUMANN PHARMA GMBH & CO (DE) | 1988-01-07 | — | — | EP | disclosed |