Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | CCR8 | P51685 | 1/20 | 0.38 |
| ▸ | PREP | P48147 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL1307233 | 1.00 | KDM4E (0.40) | KDM4ECNR2P2RX3DRD4CNR1 | |
| SCHEMBL1307079 | 0.95 | P2RX3 (0.42) | KDM4ECNR2P2RX3DRD4CNR1 | |
| SCHEMBL1307082 | 0.95 | P2RX3 (0.42) | KDM4ECNR2P2RX3DRD4CNR1 | |
| SCHEMBL1306723 | 0.92 | KDM4E (0.43) | KDM4EP2RX3DRD4ALDH1A1HPGD | |
| SCHEMBL1306726 | 0.92 | KDM4E (0.43) | KDM4EP2RX3DRD4ALDH1A1HPGD | |
| SCHEMBL29488471 | 0.91 | P2RX3 (0.42) | KDM4EP2RX3ALDH1A1HPGDTDP1 | |
| SCHEMBL1306218 | 0.91 | P2RX3 (0.42) | KDM4EP2RX3ALDH1A1HPGDTDP1 | |
| SCHEMBL1306220 | 0.91 | P2RX3 (0.42) | KDM4EP2RX3ALDH1A1HPGDTDP1 | |
| SCHEMBL1306839 | 0.90 | CNR2 (0.40) | KDM4ECNR2P2RX3CNR1ALDH1A1 | |
| SCHEMBL1306841 | 0.90 | CNR2 (0.40) | KDM4ECNR2P2RX3CNR1ALDH1A1 |
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 |