Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18341003 | 0.78 | GABRA1 (0.50) | GABRA1GABRB2ALDH1A1POLBMAPT | |
| SCHEMBL11399402 | 0.75 | CTRC (0.35) | ALDH1A1POLBMAPTHTT | |
| SCHEMBL12658939 | 0.74 | GABRA1 (0.68) | GABRA1GABRB2 | |
| SCHEMBL11482002 | 0.70 | GABRA1 (0.44) | GABRA1GABRB2ALDH1A1MAPTALOX15 | |
| SCHEMBL6842382 | 0.70 | GABRA1 (0.70) | GABRA1GABRB2ALDH1A1MAPTALOX15 | |
| SCHEMBL19972043 | 0.69 | POLB (0.34) | GABRA1GABRB2POLBHTT | |
| Hydrochloric Acid SCHEMBL6291806 | 0.68 | GABRA1 (0.43) | GABRA1GABRB2ALDH1A1ALOX15CASP7 | |
| SCHEMBL30673419 | 0.67 | KDM4E (0.42) | GABRA1GABRB2ALDH1A1POLBMAPT | |
| SCHEMBL560494 | 0.67 | KDM4E (0.42) | GABRA1GABRB2ALDH1A1POLBMAPT | |
| SCHEMBL23647910 | 0.67 | GABRA1 (0.46) | GABRA1GABRB2POLBHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0002231-A1 | 1-N-aryl-1,4-dihydropyridines, process for their preparation and their pharmaceutical application | BAYER AG (DE) | 1979-06-13 | — | — | EP | disclosed |