Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 9/20 | 0.47 |
| ▸ | DRD2 | P14416 | 5/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | GCGR | P47871 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1307948 | 1.00 | P2RX3 (0.52) | P2RX3DRD4DRD2MCHR1SIGMAR1 | |
| SCHEMBL1307324 | 0.93 | P2RX3 (0.54) | P2RX3DRD4DRD2SIGMAR1DRD3 | |
| SCHEMBL1307322 | 0.93 | P2RX3 (0.54) | P2RX3DRD4DRD2SIGMAR1DRD3 | |
| SCHEMBL1307082 | 0.91 | P2RX3 (0.42) | P2RX3DRD4DRD2 | |
| SCHEMBL1307079 | 0.91 | P2RX3 (0.42) | P2RX3DRD4DRD2 | |
| SCHEMBL29488484 | 0.91 | P2RX3 (0.55) | P2RX3DRD4DRD2SIGMAR1DRD3 | |
| SCHEMBL1305009 | 0.91 | P2RX3 (0.55) | P2RX3DRD4DRD2SIGMAR1DRD3 | |
| SCHEMBL1305012 | 0.91 | P2RX3 (0.55) | P2RX3DRD4DRD2SIGMAR1DRD3 | |
| SCHEMBL2895879 | 0.88 | ALDH1A1 (0.39) | P2RX3 | |
| SCHEMBL2895878 | 0.88 | ALDH1A1 (0.39) | P2RX3 |
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 |