Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 2/20 | 0.73 |
| ▸ | CASP3 | P42574 | 2/20 | 0.73 |
| ▸ | CASP4 | P49662 | 2/20 | 0.73 |
| ▸ | CASP7 | P55210 | 2/20 | 0.73 |
| ▸ | CASP9 | P55211 | 2/20 | 0.73 |
| ▸ | CASP6 | P55212 | 2/20 | 0.73 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.73 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.58 |
| ▸ | ACHE | P22303 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 5/20 | 0.55 |
| ▸ | CA1 | P00915 | 5/20 | 0.55 |
| ▸ | CA2 | P00918 | 5/20 | 0.55 |
| ▸ | CA9 | Q16790 | 5/20 | 0.55 |
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.49 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28026202 | 0.85 | ALDH1A1 (0.65) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL8019337 | 0.85 | CASP3 (1.00) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL18954527 | 0.83 | CASP1 (0.70) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL9904848 | 0.82 | ALDH3A1 (0.72) | CHRM5ALDH1A1CA12CA1CA2 | |
| SCHEMBL8019897 | 0.81 | CASP3 (0.79) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL5659567 | 0.80 | ALDH1A1 (0.71) | CHRM5ACHEALDH1A1CA12CA1 | |
| SCHEMBL5659656 | 0.80 | ACHE (0.66) | CHRM5ACHEALDH1A1CA12CA1 | |
| SCHEMBL18954802 | 0.79 | CHRM5 (0.60) | CASP3CASP7CASP6CHRM5ACHE | |
| SCHEMBL4609842 | 0.79 | CES1 (0.66) | CHRM5ACHEALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL18954800 | 0.78 | CHRM5 (0.58) | CASP3CASP7CASP6CHRM5ACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104829608-B | A kind of cumarin thiazole indolone type compound and its preparation method and purposes | 吉首大学 | 2017-06-30 | — | — | CN | disclosed |
| CN-104829608-A | Coumarin-thiazole-indolone compounds, and preparation method and application thereof | UNIV JISHOU | 2015-08-12 | — | — | CN | disclosed |