Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.39 |
| ▸ | PIK3C3 | Q8NEB9 | 3/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4540574 | 0.89 | ALDH1A1 (0.40) | PGK1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL3569660 | 0.79 | KDM4E (0.43) | PGK1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL7335095 | 0.69 | ALDH1A1 (0.53) | ALDH1A1HPGDKDM4EHSD17B10SIRT2 | |
| SCHEMBL2122993 | 0.68 | ALDH1A1 (0.77) | ALDH1A1HPGDKDM4EHSD17B10MEN1 | |
| SCHEMBL4540580 | 0.68 | MAPK8 (0.50) | PGK1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL2904340 | 0.68 | UTS2R (0.41) | PGK1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL27953621 | 0.67 | HCAR3 (0.41) | PGK1ALDH1A1KDM4EHSD17B10GAA | |
| SCHEMBL18992945 | 0.67 | MKNK1 (0.40) | ALDH1A1HPGDKDM4EHSD17B10SIRT2 | |
| SCHEMBL21749966 | 0.66 | BRD4 (0.53) | ALDH1A1HPGDKDM4EMEN1KMT2A | |
| SCHEMBL27927983 | 0.66 | KDM4E (0.49) | ALDH1A1HPGDKDM4EHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009140164-A1 | 6-AMINONICOTINAMIDE DERIVATIVES AS POTENT AND SELECTIVE HISTONE DEACETYLASE INHIBITORS | CHIPSCREEN BIOSCIENCES LTD. (CN) | 2009-11-19 | — | — | WO | disclosed |