Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 4/20 | 0.50 |
| ▸ | PGK1 | P00558 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | DHODH | Q02127 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 1/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.39 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23009954 | 0.78 | KDM4E (0.43) | MAPK8PGK1ALDH1A1HSD17B10KDM4E | |
| SCHEMBL3569662 | 0.78 | PARP1 (0.55) | MAPK8PGK1ALDH1A1HSD17B10KDM4E | |
| SCHEMBL2122993 | 0.70 | ALDH1A1 (0.77) | ALDH1A1HSD17B10KDM4EHPGDPARP1 | |
| SCHEMBL912928 | 0.69 | EGFR (0.59) | MAPK8SYKMAPK9 | |
| SCHEMBL28477220 | 0.68 | NNMT (0.47) | ALDH1A1HSD17B10PARP1 | |
| SCHEMBL4540577 | 0.68 | PGK1 (0.44) | MAPK8PGK1ALDH1A1HSD17B10KDM4E | |
| SCHEMBL7092192 | 0.67 | SMN1; SMN2 (0.48) | MAPK8ALDH1A1HSD17B10KDM4EPTK2 | |
| SCHEMBL9143700 | 0.67 | KDM4E (0.46) | MAPK8ALDH1A1HSD17B10KDM4EKMT2A | |
| SCHEMBL2627049 | 0.67 | SYK (0.53) | MAPK8SYK | |
| SCHEMBL7798242 | 0.66 | KDM4E (0.72) | MAPK8ALDH1A1KDM4EHPGDMEN1 |
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 |