Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13817806 | 0.78 | HTT (0.33) | HTT | |
| SCHEMBL13817801 | 0.77 | HTT (0.40) | HTTCES1KDM4EALDH1A1HPGD | |
| SCHEMBL13817869 | 0.77 | ACACB (0.51) | HTTHPGDHSD17B10 | |
| SCHEMBL13817836 | 0.76 | ALDH1A1 (0.34) | HTTKDM4EALDH1A1 | |
| SCHEMBL13817821 | 0.70 | ALDH1A1 (0.34) | HTTCES1KDM4EALDH1A1HPGD | |
| SCHEMBL13817822 | 0.68 | ALDH1A1 (0.40) | HTTCES1KDM4EALDH1A1HPGD | |
| SCHEMBL13817791 | 0.67 | HTT (0.38) | HTTKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL13761060 | 0.66 | RARA (0.35) | KDM4EALDH1A1 | |
| SCHEMBL13817785 | 0.66 | ACACB (0.42) | HTTALDH1A1HSD17B10 | |
| SCHEMBL14001512 | 0.65 | GSK3B (0.44) | HTTCES1KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-7547660-B2 | Phenyl-substituted 4-hydroxy-tetrahydropyridones | BAYER AKTIENGESELLSCHAFT (DE) | 2009-06-16 | — | — | US | disclosed |