Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3244812 | 0.82 | L3MBTL1 (0.42) | L3MBTL1CA12CA1CA2CA9 | |
| SCHEMBL1290875 | 0.79 | KEAP1 (0.43) | BACE1SLC22A12CA1CA2CA9 | |
| SCHEMBL2336547 | 0.79 | CCNT1 (0.49) | BACE1L3MBTL1KEAP1NFE2L2ALDH1A1 | |
| SCHEMBL30764888 | 0.79 | KEAP1 (0.43) | BACE1SLC22A12CA1CA2CA9 | |
| SCHEMBL23226730 | 0.78 | ADRB3 (0.56) | ADRB3 | |
| SCHEMBL18332101 | 0.78 | KDM1A (0.51) | L3MBTL1KEAP1NFE2L2PIK3CDPIK3CA | |
| SCHEMBL5202983 | 0.78 | PIK3CD (0.47) | BACE1L3MBTL1ALDH1A1PIK3CDPIK3CA | |
| SCHEMBL19099945 | 0.77 | GAA (0.41) | L3MBTL1KEAP1NFE2L2ALDH1A1PIK3CD | |
| Ammonia Solution, Strong SCHEMBL2211253 | 0.76 | KDM1A (0.50) | L3MBTL1KEAP1NFE2L2PIK3CDPIK3CA | |
| SCHEMBL2310180 | 0.76 | PTGS1 (0.42) | L3MBTL1CA12CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010143664-A1 | TETRACYCLIC COMPOUND | 中外製薬株式会社 (JP) | 2010-12-16 | — | — | WO | disclosed |