Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.34 |
| ▸ | NMT1 | P30419 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 2/20 | 0.32 |
| ▸ | PIK3C3 | Q8NEB9 | 4/20 | 0.32 |
| ▸ | ACLY | P53396 | 1/20 | 0.31 |
| ▸ | MAP3K20 | Q9NYL2 | 2/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | ALPL | P05186 | 2/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | IDH1 | O75874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22980259 | 1.00 | PIK3CA (0.34) | PIK3CANMT1GRM5PIK3C3ACLY | |
| SCHEMBL29673452 | 0.92 | THRB (0.34) | PIK3CANMT1GRM5PIK3C3ACLY | |
| SCHEMBL22980315 | 0.92 | THRB (0.34) | PIK3CANMT1GRM5PIK3C3ACLY | |
| SCHEMBL22980440 | 0.87 | HSD11B1 (0.45) | MAP3K20 | |
| SCHEMBL29434864 | 0.87 | HSD11B1 (0.45) | MAP3K20 | |
| Trifluoroacetic Acid SCHEMBL22980528 | 0.85 | ACLY (0.34) | PIK3CAPIK3C3ACLYALPL | |
| SCHEMBL22980450 | 0.85 | PIK3CA (0.35) | PIK3CAGRM5PIK3C3ALPLCHRNB2 | |
| SCHEMBL29434829 | 0.85 | PIK3CA (0.35) | PIK3CAGRM5PIK3C3ALPLCHRNB2 | |
| SCHEMBL22980302 | 0.83 | MAP3K20 (0.44) | PIK3CAMAP3K20MCL1 | |
| SCHEMBL29434859 | 0.83 | MAP3K20 (0.44) | PIK3CAMAP3K20MCL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4013495-A1 | ARYLSULFONAMIDE DERIVATIVES AS MGLUR4 NEGATIVE ALLOSTERIC MODULATORS | F. Hoffmann-La Roche AG (CH) | 2022-06-22 | — | — | EP | claimed |
| CN-114174266-A | Arylsulfonamide derivatives as MGLUR4 negative allosteric modulators | 豪夫迈·罗氏有限公司 | 2022-03-11 | — | — | CN | claimed |
| EP-4013495-A1 | ARYLSULFONAMIDE DERIVATIVES AS MGLUR4 NEGATIVE ALLOSTERIC MODULATORS | F. Hoffmann-La Roche AG (CH) | 2022-06-22 | — | — | EP | disclosed |
| CN-114174266-A | Arylsulfonamide derivatives as MGLUR4 negative allosteric modulators | 豪夫迈·罗氏有限公司 | 2022-03-11 | — | — | CN | disclosed |