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BDBM80958 4-[(5E)-4-keto-5-[(E)-2-methyl-3-phenyl-prop-2-enylidene]-2-thioxo-thiazolidin-3-yl]butyric acid::4-[(5E)-5-[(E)-2-methyl-3-phenyl-prop-2-enylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid::4-[(5E)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid::4-[(5E)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid::MLS001173274::SMR000539031::cid_1622297
SMILES: C\C(\C=C1\SC(=S)N(CCCC(O)=O)C1=O)=C/c1ccccc1
InChI Key: InChIKey=CEKGMWZDBWCZMS-UHFFFAOYSA-N
Data: 2 IC50
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Cysteine protease ATG4B (Human) | BDBM80958![]() (SMR000539031 | 4-[(5E)-5-[(E)-2-methyl-3-phenyl-pr...) | GoogleScholar | UniChem | n/a | n/a | 1.71E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Phospholipase A2 (Human) | BDBM80958![]() (SMR000539031 | 4-[(5E)-5-[(E)-2-methyl-3-phenyl-pr...) | GoogleScholar | UniChem | n/a | n/a | 3.47E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||