Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | CACNA1C | Q13936 | 3/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.46 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.46 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7341786 | 0.90 | CACNA1C (0.59) | POLBADORA3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7343716 | 0.90 | CACNA1B (0.49) | POLBCACNA1BADORA3CYP1A2CYP3A4 | |
| SCHEMBL7349305 | 0.90 | CACNA1B (0.54) | POLBCACNA1BADORA3CYP1A2CYP3A4 | |
| SCHEMBL7349509 | 0.87 | CACNA1C (0.61) | POLBADORA3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7343611 | 0.86 | CYP1A2 (0.66) | POLBADORA3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7343553 | 0.86 | ADORA3 (0.45) | CACNA1BADORA3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7347767 | 0.84 | CACNA1B (0.49) | CACNA1BADORA3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7344616 | 0.83 | CACNA1B (0.49) | POLBCACNA1BADORA3LMNATSHR | |
| SCHEMBL7349531 | 0.83 | ADORA3 (0.55) | POLBADORA3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7348034 | 0.83 | CACNA1C (0.46) | CACNA1BADORA3CYP1A2CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-4833150-A | HYPOTENSIVES, ANTIARRHYTHMIA AGENTS | NELSON RESEARCH & DEVELOPMENT CO. (US) | 1989-05-23 | — | — | US | disclosed |
| US-4652573-A | HYPOTENSIVE AGENTS | NELSON RESEARCH & DEVELOPMENT CO. (US) | 1987-03-24 | — | — | US | disclosed |
| EP-0194685-A1 | 1,4-Dihydropyridines | Whitby Research Incorporated (US) | 1986-09-17 | — | — | EP | disclosed |