Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F12 | P00748 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | JAK1 | P23458 | 2/20 | 0.36 |
| ▸ | JAK3 | P52333 | 2/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.36 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | NEK2 | P51955 | 1/20 | 0.36 |
| ▸ | SMO | Q99835 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29939615 | 0.83 | NPSR1 (0.40) | NPSR1RXFP1BTKJAK2JAK1 | |
| SCHEMBL29725995 | 0.82 | NPSR1 (0.46) | F12NPSR1RXFP1TGFBR1TGFBR2 | |
| SCHEMBL15048610 | 0.72 | PDE10A (0.44) | F12NPSR1RXFP1KDM5AKDM5B | |
| SCHEMBL15048614 | 0.71 | PDE10A (0.45) | F12KDM5AKDM5BCFTR | |
| SCHEMBL19207113 | 0.70 | JMJD6 (0.44) | F12HCRTR1F2 | |
| SCHEMBL30839550 | 0.69 | NEK2 (0.49) | JAK2JAK1JAK3AURKANEK2 | |
| SCHEMBL20577094 | 0.68 | HCRTR1 (0.36) | F12KDM5AKDM5BJAK2JAK1 | |
| SCHEMBL3620548 | 0.67 | GRM5 (0.51) | NPSR1RXFP1TGFBR1TGFBR2GRM5 | |
| SCHEMBL23479924 | 0.67 | ADORA1 (0.44) | F12NPSR1TGFBR1HCRTR1HCRTR2 | |
| SCHEMBL5186668 | 0.66 | TGFBR1 (0.66) | TGFBR1TGFBR2 |
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-116096719-A | Pyridazinylamino derivatives as ALK5 inhibitors | 奇斯药制品公司 | 2023-05-09 | — | — | CN | disclosed |