Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.41 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.41 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL7347855 | 0.85 | MAPT (0.51) | KDM4ENPSR1POLBADORA3MAPT | |
| SCHEMBL7349712 | 0.85 | KDM4E (0.67) | KDM4ENPSR1POLBADORA3MAPT | |
| SCHEMBL7343547 | 0.83 | ADORA3 (0.47) | KDM4ENPSR1ADORA3MAPTALDH1A1 | |
| SCHEMBL7341163 | 0.83 | HSD17B10 (0.63) | KDM4ENPSR1POLBGPR55ADORA3 | |
| SCHEMBL7347558 | 0.82 | KDM4E (0.72) | KDM4ENPSR1POLBGPR55ADORA3 | |
| SCHEMBL7345495 | 0.81 | POLB (0.58) | NPSR1POLBGPR55ADORA3MAPT | |
| SCHEMBL7347551 | 0.81 | KDM4E (0.53) | KDM4ENPSR1POLBGPR55ADORA3 | |
| SCHEMBL7347564 | 0.80 | KDM4E (0.55) | KDM4ENPSR1POLBGPR55ADORA3 | |
| SCHEMBL7340139 | 0.80 | ADORA3 (0.47) | KDM4EADORA3MAPTALDH1A1HPGD | |
| SCHEMBL7342397 | 0.80 | ADORA3 (0.47) | KDM4EADORA3MAPTALDH1A1HPGD |
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 |