Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.39 |
| ▸ | FEN1 | P39748 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.35 |
| ▸ | PNLIP | P16233 | 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 | |
|---|---|---|---|---|
| SCHEMBL17241848 | 0.84 | ALOX5AP (0.43) | SCN9AALOX5APFEN1 | |
| SCHEMBL17242219 | 0.84 | ALOX5AP (0.39) | ALDH1A1SCN9AALOX5APFEN1P2RX3 | |
| SCHEMBL27865966 | 0.82 | NPC1 (0.41) | ALDH1A1SCN9AALOX5APFEN1GAA | |
| SCHEMBL1137111 | 0.80 | RAF1 (0.46) | SCN9AP2RX3GRM4PNLIPPDE7A | |
| SCHEMBL631806 | 0.77 | ALDH1A1 (0.52) | ALDH1A1GAAMEN1MAPTKMT2A | |
| SCHEMBL17242259 | 0.76 | SCN9A (0.43) | ALDH1A1SCN9AALOX5APFEN1MEN1 | |
| SCHEMBL10610427 | 0.69 | CYP3A4 (0.42) | ALDH1A1GAAMEN1MAPTKMT2A | |
| SCHEMBL1964539 | 0.69 | CYP3A4 (0.56) | ALDH1A1GAAMEN1MAPTKMT2A | |
| SCHEMBL2789425 | 0.69 | NNMT (0.46) | ALOX5APFEN1LMNAADRA1DADRA1A | |
| SCHEMBL17242285 | 0.68 | P2RX3 (0.41) | ALDH1A1SCN9AALOX5APFEN1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105085482-A | Substituted piperazine compound, and usage method and application thereof | GUANGDONG HEC PHARMACEUTICAL | 2015-11-25 | — | — | CN | disclosed |
| WO-2015169180-A1 | SUBSTITUTED PIPERAZINE COMPOUNDS AND METHODS AND USE THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2015-11-12 | — | — | WO | disclosed |