Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | PREP | P48147 | 2/20 | 0.36 |
| ▸ | CASP1 | P29466 | 2/20 | 0.36 |
| ▸ | CASP3 | P42574 | 2/20 | 0.36 |
| ▸ | CASP7 | P55210 | 2/20 | 0.36 |
| ▸ | CASP8 | Q14790 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | SLC6A5 | Q9Y345 | 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 | |
|---|---|---|---|---|
| SCHEMBL1306116 | 1.00 | CNR2 (0.38) | CNR2CNR1P2RX3ALDH1A1KDM4E | |
| SCHEMBL1306855 | 0.95 | CNR2 (0.39) | CNR2CNR1P2RX3ALDH1A1KDM4E | |
| SCHEMBL1306856 | 0.95 | CNR2 (0.39) | CNR2CNR1P2RX3ALDH1A1KDM4E | |
| SCHEMBL1305989 | 0.93 | ALDH1A1 (0.41) | P2RX3ALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL1305993 | 0.93 | ALDH1A1 (0.41) | P2RX3ALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL1306861 | 0.91 | P2RX3 (0.39) | P2RX3ALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL29488476 | 0.91 | P2RX3 (0.39) | P2RX3ALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL1306864 | 0.91 | P2RX3 (0.39) | P2RX3ALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL1307079 | 0.88 | P2RX3 (0.42) | CNR2CNR1P2RX3ALDH1A1KDM4E | |
| SCHEMBL1307082 | 0.88 | P2RX3 (0.42) | CNR2CNR1P2RX3ALDH1A1KDM4E |
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 |