Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | HTR3A | P46098 | 3/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.39 |
| ▸ | HTR3B | O95264 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28722001 | 1.00 | GAA (0.49) | GAAHTR3ABACE1KDM4EL3MBTL1 | |
| SCHEMBL29496052 | 0.87 | GAA (0.62) | GAAHTR3ABACE1KDM4EALDH1A1 | |
| SCHEMBL28722011 | 0.87 | GAA (0.62) | GAAHTR3ABACE1KDM4EALDH1A1 | |
| SCHEMBL28722866 | 0.85 | GAA (0.68) | GAAHTR3ABACE1KDM4EHTT | |
| SCHEMBL3299921 | 0.85 | HTR3A (0.58) | GAAHTR3ABACE1KDM4ETDP1 | |
| SCHEMBL29495981 | 0.85 | GAA (0.68) | GAAHTR3ABACE1KDM4EHTT | |
| SCHEMBL29496124 | 0.83 | GAA (0.43) | GAAHTR3ABACE1ADRB1HRH3 | |
| SCHEMBL28722181 | 0.83 | GAA (0.43) | GAAHTR3ABACE1ADRB1HRH3 | |
| SCHEMBL23714071 | 0.79 | GAA (0.62) | GAAHTR3AKDM4EL3MBTL1TDP1 | |
| SCHEMBL15472859 | 0.78 | GAA (0.72) | GAAHTR3AKDM4EL3MBTL1TDP1 |
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-114269730-A | 5-heteroaryl-pyridin-2-amine compounds as neuropeptide FF receptor antagonists | 多曼治疗学公司 | 2022-04-01 | — | — | CN | disclosed |