Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.51 |
| ▸ | PDGFRA | P16234 | 3/20 | 0.51 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.49 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.49 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.49 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.49 |
| ▸ | MAP4K5 | Q9Y4K4 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.49 |
| ▸ | CCR1 | P32246 | 1/20 | 0.48 |
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.44 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16512107 | 1.00 | CYP1A2 (0.53) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 | |
| SCHEMBL3826111 | 0.80 | BIRC5 (0.59) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 | |
| SCHEMBL12270009 | 0.79 | NPC1 (0.62) | PDGFRACYP2A6CCR1CCR8TGFBR1 | |
| SCHEMBL27062709 | 0.79 | PDGFRB (0.54) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 | |
| SCHEMBL32667946 | 0.78 | PDGFRB (0.77) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 | |
| SCHEMBL2772360 | 0.78 | PDGFRB (0.77) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 | |
| SCHEMBL2681535 | 0.77 | PDGFRB (0.56) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 | |
| SCHEMBL29419045 | 0.77 | PDGFRB (0.56) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 | |
| SCHEMBL18812500 | 0.77 | PDGFRB (0.61) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 | |
| SCHEMBL12386954 | 0.77 | CYP1A2 (0.62) | CYP1A2PDGFRBPDGFRABIRC5MAP4K4 |
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-118702671-A | 2- [ 2-Methyl-6- (quinoline-3-yl) nicotinyl ] -N-phenylhydrazine-1-carboxamide derivative, preparation method and application | 浙江师范大学行知学院 | 2024-09-27 | — | — | CN | disclosed |