Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 6/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL22969399 | 0.84 | HTR3A (0.42) | HTR3ACNR2ADRB1PTPN11TRPV3 | |
| SCHEMBL29495813 | 0.84 | HTR3A (0.42) | HTR3ACNR2ADRB1PTPN11TRPV3 | |
| SCHEMBL29496062 | 0.82 | GAA (0.48) | HTR3ACNR2ADRB1GAAPDE10A | |
| SCHEMBL29496188 | 0.73 | MAP4K4 (0.41) | HTR3APARP1GAA | |
| SCHEMBL29496060 | 0.72 | PARP1 (0.40) | PARP1MAPK1PDE10A | |
| SCHEMBL29495986 | 0.71 | HTR3A (0.47) | HTR3AADRB1GAAPDE10AHRH3 | |
| SCHEMBL22969580 | 0.71 | HTR3A (0.47) | HTR3AADRB1GAAPDE10AHRH3 | |
| SCHEMBL29496124 | 0.70 | GAA (0.43) | HTR3ACNR2ADRB1TRPV3GAA | |
| SCHEMBL28722181 | 0.70 | GAA (0.43) | HTR3ACNR2ADRB1TRPV3GAA | |
| SCHEMBL29496033 | 0.69 | PARP1 (0.37) | CNR2TRPV3PARP1 |
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 |