Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1308416 | 0.86 | HPGD (0.46) | GAAPOLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1308420 | 0.86 | HPGD (0.46) | GAAPOLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1305937 | 0.85 | GAA (0.47) | GAAPOLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1305938 | 0.85 | GAA (0.47) | GAAPOLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1307005 | 0.85 | CYP1A2 (0.41) | GAAPOLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1306200 | 0.85 | HPGD (0.48) | GAAPOLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1307181 | 0.84 | ALDH1A1 (0.43) | KMT2AHPGDALDH1A1KDM4ETDP1 | |
| SCHEMBL1306520 | 0.83 | ADAMTS5 (0.41) | KMT2AHPGDALDH1A1KDM4ETDP1 | |
| SCHEMBL1305360 | 0.83 | GAA (0.45) | GAAPOLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL29488481 | 0.83 | GAA (0.45) | GAAPOLBCYP1A2CYP3A4CYP2C19 |
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-8053435-B2 | Naphthalenyloxypropenyl derivatives having inhibitory activity against histone deacetylase and pharmaceutical composition comprising the same | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2011-11-08 | — | — | US | disclosed |