Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | CCKBR | P32239 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.47 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL7396515 | 0.94 | ADORA3 (0.43) | ADORA3AGTR1SCN5AMEN1CYP1A2 | |
| SCHEMBL7403448 | 0.94 | ADORA3 (0.43) | ADORA3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9492201 | 0.93 | CACNA1C (0.52) | ADORA3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9484462 | 0.91 | ADORA3 (0.51) | ADORA3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7403196 | 0.91 | ADORA3 (0.51) | ADORA3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7406363 | 0.90 | ADORA3 (0.39) | ADORA3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7406356 | 0.90 | ADORA3 (0.39) | ADORA3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9484992 | 0.87 | CACNA1C (0.53) | ADORA3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7403809 | 0.87 | ADORA3 (0.65) | ADORA3NR1I2NR3C1ABCB1TBXA2R | |
| SCHEMBL9789920 | 0.86 | ADORA3 (0.52) | ADORA3AGTR1SCN5AMEN1CYP1A2 |
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 |