Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL1307933 | 0.91 | P2RX3 (0.51) | P2RX3ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1307936 | 0.91 | P2RX3 (0.51) | P2RX3ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1305453 | 0.90 | P2RX3 (0.46) | P2RX3ALDH1A1HPGDCYP1A2CYP2C9 | |
| SCHEMBL1306511 | 0.90 | P2RX3 (0.53) | P2RX3ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1306507 | 0.90 | P2RX3 (0.53) | P2RX3ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1307087 | 0.88 | P2RX3 (0.49) | P2RX3ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1306160 | 0.85 | KMT2A (0.45) | P2RX3ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1307038 | 0.83 | ALDH1A1 (0.51) | P2RX3ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1307039 | 0.83 | ALDH1A1 (0.51) | P2RX3ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL12113377 | 0.83 | ALDH1A1 (0.51) | P2RX3ALDH1A1TSHRMEN1KMT2A |
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 |