Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PYGL | P06737 | 13/20 | 0.41 |
| ▸ | PYGM | P11217 | 13/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL10649530 | 0.92 | PYGL (0.39) | ALDH1A1POLBHTTSMN1; SMN2PYGL | |
| SCHEMBL9829022 | 0.89 | PYGL (0.48) | PYGLPYGM | |
| SCHEMBL10376310 | 0.84 | POLB (0.43) | ALDH1A1POLBHTTSMN1; SMN2PYGL | |
| SCHEMBL10968852 | 0.80 | PYGM (0.37) | ALDH1A1PYGLPYGMTSHRKDM4E | |
| SCHEMBL9865516 | 0.80 | PYGL (0.48) | ALDH1A1POLBHTTSMN1; SMN2PYGL | |
| SCHEMBL10653759 | 0.79 | CYP3A4 (0.39) | ALDH1A1POLBHTTSMN1; SMN2PYGL | |
| SCHEMBL30157261 | 0.79 | PYGM (0.62) | PYGLPYGM | |
| SCHEMBL4072118 | 0.79 | PYGM (0.62) | PYGLPYGM | |
| SCHEMBL9689389 | 0.79 | KDM4E (0.40) | ALDH1A1KDM4E | |
| SCHEMBL10659301 | 0.78 | PYGL (0.52) | ALDH1A1PYGLPYGM |
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-0158138-A1 | 1-Alkyl-substituted 1,4-dihydropyridine lactones, method for their preparation and their use in medicines | BAYER AG (DE) | 1985-10-16 | — | — | EP | claimed |