Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.62 |
| ▸ | CASP1 | P29466 | 3/20 | 0.57 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL7343553 | 0.84 | ADORA3 (0.45) | KDM4EHSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL7349531 | 0.84 | ADORA3 (0.55) | KDM4EHSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL7348034 | 0.84 | CACNA1C (0.46) | KDM4EHSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL7347767 | 0.84 | CACNA1B (0.49) | KDM4EHSD17B10CASP1CASP7ALDH1A1 | |
| SCHEMBL10744175 | 0.84 | ALDH1A1 (0.51) | KDM4EHSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL7342398 | 0.83 | ADORA3 (0.43) | KDM4EHSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL7349721 | 0.82 | KDM4E (0.62) | KDM4EHSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL7348456 | 0.81 | ADORA3 (0.43) | SMN1; SMN2ADORA3MAPTCYP2C9CYP1A2 | |
| SCHEMBL7344616 | 0.81 | CACNA1B (0.49) | KDM4EHSD17B10CASP1CASP7ALDH1A1 | |
| SCHEMBL7340150 | 0.81 | ADORA3 (0.42) | KDM4EHSD17B10ALDH1A1HPGDGAA |
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 |