Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.90 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.90 |
| ▸ | CASP1 | P29466 | 2/20 | 0.90 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.62 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.56 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.51 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.51 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.51 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.51 |
| ▸ | CACNA1B | Q00975 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 5/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | CASP7 | P55210 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | XBP1 | P17861 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7154694 | 0.95 | KDM4E (1.00) | KDM4EHSD17B10CASP1ALDH1A1ADORA3 | |
| SCHEMBL11868541 | 0.90 | KDM4E (0.90) | KDM4EHSD17B10CASP1ALDH1A1ADORA3 | |
| SCHEMBL7158896 | 0.90 | KDM4E (0.90) | KDM4EHSD17B10CASP1ALDH1A1ADORA3 | |
| SCHEMBL11681065 | 0.88 | KDM4E (0.70) | KDM4EHSD17B10CASP1ALDH1A1ADORA3 | |
| SCHEMBL7265761 | 0.88 | KDM4E (0.70) | KDM4EHSD17B10CASP1ALDH1A1ADORA3 | |
| SCHEMBL9806876 | 0.88 | KDM4E (0.71) | KDM4EHSD17B10CASP1ALDH1A1CACNA1D | |
| SCHEMBL11875933 | 0.88 | KDM4E (0.85) | KDM4EHSD17B10CASP1ALDH1A1ADORA3 | |
| SCHEMBL11755854 | 0.87 | KDM4E (0.69) | KDM4EHSD17B10CASP1ALDH1A1CACNA1D | |
| SCHEMBL11752038 | 0.87 | KDM4E (0.69) | KDM4EHSD17B10CASP1ALDH1A1ADORA3 | |
| SCHEMBL7160175 | 0.87 | KDM4E (0.90) | KDM4EHSD17B10CASP1ALDH1A1ADORA3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4988717-A | Optically active 1,4-dihydropyridine esters useful for treating circulatory illnesses | BAYER AKTIENGESELLSCHAFT (DE) | 1991-01-29 | — | — | US | disclosed |
| US-4920225-A | Resolution of 1,4-dihydropyridine derivatives | LABORATOIRES SYNTEX S.A. (FR) | 1990-04-24 | — | — | US | disclosed |
| US-4849433-A | The compound, (⃡)1,4-dihydro-2,6-dimethyl-4-(2'-nitrophenyl)-pyridine-3,5-dicarboxylic acid, methyl isobutyl ester, compositions containing same and a method for effecting coronary dilation | BAYER AKTIENGESELLSCHAFT (DE) | 1989-07-18 | — | — | US | disclosed |
| EP-0273349-A2 | Resolution of 1,4-dihydropyridine derivatives | LABORATOIRES SYNTEX S.A. (FR) | 1988-07-06 | — | — | EP | disclosed |
| US-4510310-A | 1,4-Dihydro-2,6-dimethyl-4-(2'-chlorophenyl)-3,5-dicarboxylic acid,methyl or ethyl,trifluoroethyl ester | BAYER AKTIENGESELLSCHAFT (DE) | 1985-04-09 | — | — | US | disclosed |