Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL201692 | 0.98 | NPC1 (0.57) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL27977349 | 0.96 | NPC1 (0.55) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL28215541 | 0.96 | NPC1 (0.55) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL1022838 | 0.94 | NPC1 (0.53) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL11801101 | 0.94 | PTGS2 (0.61) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL5171088 | 0.92 | NPC1 (0.52) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL1023152 | 0.92 | HPGD (0.52) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL11773665 | 0.92 | PTGS2 (0.62) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL201072 | 0.92 | PTGS2 (0.62) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL13124313 | 0.92 | PTGS2 (0.62) | NPC1HPGDMAPK1HTTRAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106458823-A | Process for preparing unsaturated carboxylic acid salts | 巴斯夫欧洲公司 | 2017-02-22 | — | — | CN | claimed |
| CN-105008378-B | The manufacturing method of cross-coupling catalysts and aromatic compound | 北兴化学工业株式会社 | 2018-05-18 | — | — | CN | disclosed |
| CN-105008378-A | Reaction catalyst for cross coupling and method for manufacturing aromatic compound | HOKKO CHEM IND CO | 2015-10-28 | — | — | CN | disclosed |