Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.46 |
| ▸ | CASP1 | P29466 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.44 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CASP7 | P55210 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10744175 | 0.85 | ALDH1A1 (0.51) | ADORA3KDM4EHSD17B10HPGDPKM | |
| SCHEMBL7349531 | 0.83 | ADORA3 (0.55) | ADORA3KDM4EHSD17B10HPGDCACNA1F | |
| SCHEMBL7343553 | 0.83 | ADORA3 (0.45) | CACNA1BADORA3KDM4EHSD17B10HPGD | |
| SCHEMBL7348034 | 0.83 | CACNA1C (0.46) | CACNA1BADORA3KDM4EHSD17B10HPGD | |
| SCHEMBL7341786 | 0.83 | CACNA1C (0.59) | ADORA3CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL7347767 | 0.83 | CACNA1B (0.49) | CACNA1BADORA3KDM4EHSD17B10CASP1 | |
| SCHEMBL7349305 | 0.83 | CACNA1B (0.54) | CACNA1BADORA3KDM4EHSD17B10HPGD | |
| SCHEMBL7343716 | 0.83 | CACNA1B (0.49) | CACNA1BADORA3KDM4ECACNA1FCACNA1D | |
| SCHEMBL7345505 | 0.83 | POLB (0.55) | CACNA1BADORA3KDM4ECACNA1FCACNA1D | |
| SCHEMBL7342398 | 0.82 | ADORA3 (0.43) | CACNA1BADORA3KDM4EHSD17B10HPGD |
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 |