Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | BAP1 | Q92560 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10996510 | 0.89 | HSD17B10 (0.52) | ALDH1A1HSD17B10CASP1HPGDCASP7 | |
| SCHEMBL7272913 | 0.86 | KMT2A (0.46) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL7273183 | 0.85 | HSD17B10 (0.41) | ALDH1A1HSD17B10CASP1HPGDCASP7 | |
| SCHEMBL7264264 | 0.82 | LMNA (0.47) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL10866129 | 0.78 | KMT2A (0.45) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL10870367 | 0.77 | ALDH1A1 (0.43) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL7272930 | 0.76 | KMT2A (0.45) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL10867143 | 0.75 | KDM4E (0.42) | ALDH1A1HSD17B10HPGDTSHRMAPT | |
| SCHEMBL10864205 | 0.75 | ALDH1A1 (0.34) | ALDH1A1HSD17B10CASP1HPGDCASP7 | |
| SCHEMBL10620583 | 0.74 | CYP2C9 (0.56) | ALDH1A1HSD17B10HPGDTSHRMAPT |
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-0116708-A1 | Substituted 1,4-dihydropyridines, method for their preparation and their use as pharmaceuticals | CASSELLA Aktiengesellschaft (DE) | 1984-08-29 | — | — | EP | disclosed |