Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.52 |
| ▸ | NOS2 | P35228 | 1/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6161979 | 1.00 | NOS3 (0.52) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL20448716 | 0.80 | NOS3 (0.52) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL29775960 | 0.80 | NOS3 (0.52) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL9004182 | 0.80 | HDAC8 (0.37) | NOS3NOS2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL2334808 | 0.80 | NOS3 (0.52) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL28726473 | 0.77 | NOS3 (0.48) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL18857402 | 0.76 | MAPK1 (0.37) | MAPK1ALDH1A1HDAC8NPSR1NPC1 | |
| SCHEMBL20927047 | 0.74 | PRKCQ (0.34) | HDAC8 | |
| SCHEMBL31275586 | 0.74 | JAK2 (0.42) | HDAC8 | |
| SCHEMBL6159726 | 0.74 | NOS3 (0.46) | NOS3NOS2ADRB1MAPK1ADRB2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108368064-B | 1,2, 3-triazole derivative and insecticide and acaricide comprising the same as active ingredient | 北兴化学工业株式会社 | 2022-04-26 | — | — | CN | disclosed |