Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.38 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28691522 | 1.00 | APP (0.43) | APPMAPK14SYKHRH3EGFR | |
| SCHEMBL29587661 | 0.88 | FFAR4 (0.42) | HRH3PTGS1PTGS2FFAR4 | |
| SCHEMBL15057385 | 0.88 | FFAR4 (0.42) | HRH3PTGS1PTGS2FFAR4 | |
| SCHEMBL2836322 | 0.87 | APP (0.43) | APPMAPK14SYKHRH3PTGS1 | |
| SCHEMBL15785548 | 0.85 | APP (0.45) | APPMAPK14SYKHRH3EGFR | |
| SCHEMBL31680180 | 0.85 | PTGS1 (0.44) | APPHRH3PTGS1PTGS2FFAR4 | |
| SCHEMBL16482942 | 0.85 | PTGS1 (0.44) | APPHRH3PTGS1PTGS2FFAR4 | |
| SCHEMBL23092223 | 0.81 | HRH3 (0.38) | APPMAPK14SYKHRH3 | |
| SCHEMBL15782898 | 0.81 | SYK (0.44) | APPMAPK14SYKHRH3EGFR | |
| SCHEMBL30046098 | 0.81 | HRH3 (0.38) | APPMAPK14SYKHRH3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114149423-B | Tetrahydropyridopyrimidinedione derivative, preparation method thereof and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2023-12-12 | — | — | CN | disclosed |
| CN-116171276-A | 3- ((1H-pyrazol-4-yl) methyl) -6'- (phenyl) -2H- [1,2' -bipyridin ] -2-one derivatives and related compounds as GRP139 antagonists in methods of treating E.G. depression | 武田药品工业株式会社 | 2023-05-26 | — | — | CN | disclosed |
| CN-114149423-A | Tetrahydropyridopyrimidine diketone derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2022-03-08 | — | — | CN | disclosed |