Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3820989 | 1.00 | TSHR (0.43) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3812735 | 0.95 | P2RX3 (0.43) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3820442 | 0.95 | P2RX3 (0.43) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3813526 | 0.91 | P2RX3 (0.51) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3819413 | 0.91 | P2RX3 (0.45) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3817452 | 0.89 | P2RX3 (0.44) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3813475 | 0.86 | P2RX3 (0.45) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3848540 | 0.85 | P2RX3 (0.45) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3816350 | 0.84 | SLC6A4 (0.40) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3817623 | 0.84 | P2RX3 (0.43) | TSHRP2RX3SLC6A2SLC6A4SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2089354-A1 | NAPHTHALENYLOXYPROPENYL DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | Korea Research Institute Of Chemical Technology (KR) | 2009-08-19 | — | — | EP | disclosed |
| WO-2008054154-A1 | NAPHTHALENYLOXYPROPENYL DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2008-05-08 | — | — | WO | disclosed |