Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7406363 | 1.00 | ADORA3 (0.39) | ADORA3CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7403448 | 0.96 | ADORA3 (0.43) | ADORA3CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7396515 | 0.95 | ADORA3 (0.43) | ADORA3CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7396469 | 0.93 | CACNA1C (0.40) | ADORA3CACNA1C | |
| SCHEMBL7396467 | 0.93 | CACNA1C (0.40) | ADORA3CACNA1C | |
| SCHEMBL7403196 | 0.91 | ADORA3 (0.51) | ADORA3CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9484462 | 0.91 | ADORA3 (0.51) | ADORA3CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7399677 | 0.90 | ADORA3 (0.47) | ADORA3CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9484992 | 0.88 | CACNA1C (0.53) | ADORA3CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9789920 | 0.86 | ADORA3 (0.52) | ADORA3CYP1A2CYP3A4CYP2C9CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995020576-A1 | 4-(2-(3-ARYLOXY-2-HYDROXYPROPYLAMINO ALKYLOXY)-5-NITROPHENYL)-1,4-DIHYDROPYRIDINES AS ANTIHYPERTENSIVE AGENTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-08-03 | — | — | WO | disclosed |