Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | BRDT | Q58F21 | 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 | |
|---|---|---|---|---|
| SCHEMBL10775020 | 0.87 | ALDH1A1 (0.41) | ALDH1A1KDM4EHSD17B10TSHRADORA2B | |
| SCHEMBL10424778 | 0.86 | HSD17B10 (0.52) | ALDH1A1KDM4EHSD17B10TSHRADORA2B | |
| SCHEMBL9691243 | 0.80 | ALDH1A1 (0.46) | ALDH1A1KDM4EHSD17B10TSHRADORA2B | |
| SCHEMBL9828158 | 0.79 | PYGM (0.35) | — | |
| SCHEMBL11168071 | 0.76 | KDM4E (0.43) | ALDH1A1KDM4ETSHRMAPTCYP1A2 | |
| SCHEMBL10424603 | 0.76 | HSD17B10 (0.56) | ALDH1A1KDM4EHSD17B10TSHRADORA2B | |
| SCHEMBL11117972 | 0.75 | NR1I2 (0.45) | ALDH1A1KDM4EHSD17B10TSHRMAPT | |
| SCHEMBL11116098 | 0.75 | KMT2A (0.44) | ALDH1A1KDM4EHSD17B10TSHRMAPT | |
| SCHEMBL9691212 | 0.75 | KDM4E (0.43) | ALDH1A1KDM4EMAPTRECQLHPGD | |
| SCHEMBL10426237 | 0.74 | HSD17B10 (0.52) | ALDH1A1KDM4EHSD17B10TSHRADORA2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0229963-B1 | 4-THIENYL-DIHYDROPYRIDINES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL PREPARATIONS | BAYER AG (DE) | 1991-09-11 | — | — | EP | disclosed |
| EP-0229963-A2 | 4-Thienyl-dihydropyridines, process for their preparation and their use as pharmaceutical preparations | BAYER AG (DE) | 1987-07-29 | — | — | EP | disclosed |