Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 8/20 | 0.96 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.96 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.96 |
| ▸ | HPGD | P15428 | 7/20 | 0.96 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.96 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.96 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.96 |
| ▸ | THRB | P10828 | 1/20 | 0.96 |
| ▸ | HTT | P42858 | 1/20 | 0.68 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.68 |
| ▸ | CASP1 | P29466 | 5/20 | 0.61 |
| ▸ | CASP7 | P55210 | 5/20 | 0.61 |
| ▸ | GAA | P10253 | 4/20 | 0.61 |
| ▸ | GLA | P06280 | 3/20 | 0.61 |
| ▸ | CA9 | Q16790 | 3/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | CA12 | O43570 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| 4-Methylesculetin SCHEMBL409482 | 0.98 | MCL1 (1.00) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| 4-Methylesculetin SCHEMBL29361762 | 0.98 | MCL1 (1.00) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| 4-Methylesculetin SCHEMBL27453331 | 0.96 | ALDH1A1 (0.96) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL24865598 | 0.89 | ALDH1A1 (0.82) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| 4-Methylesculetin SCHEMBL6262439 | 0.87 | MCL1 (0.78) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| 4-Methylesculetin SCHEMBL7798943 | 0.84 | KDM4E (0.73) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL6904172 | 0.84 | ALDH1A1 (0.74) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL580501 | 0.84 | ALDH1A1 (0.74) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL22031603 | 0.84 | ALDH1A1 (0.74) | MCL1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL31357189 | 0.84 | MCL1 (1.00) | MCL1ALDH1A1KDM4EHPGDHSD17B10 |
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-6761879-B1 | ANTICARIES AGENTS | SANOFI-SYNTHELABO (FR) | 2004-07-13 | — | — | US | disclosed |