Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 8/20 | 0.54 |
| ▸ | LTB4R2 | Q9NPC1 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TSPO | P30536 | 1/20 | 0.42 |
| ▸ | CPB1 | P15086 | 1/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 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 | |
|---|---|---|---|---|
| SCHEMBL2158851 | 0.93 | LTB4R2 (0.48) | PTGDR2LTB4R2NPC1ALDH1A1HTT | |
| SCHEMBL2158429 | 0.92 | LTB4R2 (0.47) | PTGDR2LTB4R2NPC1ALDH1A1HTT | |
| SCHEMBL2158287 | 0.91 | PTGDR2 (0.46) | PTGDR2LTB4R2NPC1ALDH1A1HTT | |
| SCHEMBL2158410 | 0.90 | PTGES (0.48) | PTGDR2LTB4R2NPC1ALDH1A1HTT | |
| SCHEMBL2157522 | 0.89 | PTGDR2 (0.56) | PTGDR2TSPOHSD17B1HSD17B2 | |
| SCHEMBL2157488 | 0.88 | CRHBP (0.45) | PTGDR2LTB4R2ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL2158771 | 0.87 | KMT2A (0.46) | PTGDR2LTB4R2NPC1ALDH1A1HTT | |
| SCHEMBL2158746 | 0.86 | LTB4R2 (0.52) | PTGDR2LTB4R2NPC1ALDH1A1HTT | |
| SCHEMBL2157674 | 0.85 | PTGDR2 (0.42) | PTGDR2LTB4R2ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL2157848 | 0.82 | RAB9A (0.48) | PTGDR2LTB4R2NPC1ALDH1A1HTT |
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-7985769-B2 | Compounds and methods for the treatment or prevention of Flavivirus infections | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-07-26 | — | — | US | disclosed |