BDBM93577 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] ester::2-methyl-5-morpholinosulfonyl-benzoic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl] ester::MLS000054116::SMR000061586::[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate::[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-methyl-5-morpholin-4-ylsulfonylbenzoate::cid_2362535

SMILES Cc1ccc(cc1C(=O)OCC(=O)N1CCc2ccccc2C1)S(=O)(=O)N1CCOCC1

InChI Key InChIKey=WTUOQXPSEFTEEC-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 93577   

TargetCaspase-3(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM93577(2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [2-...)
Affinity DataIC50:  9.27E+4nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetSentrin-specific protease 8(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM93577(2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [2-...)
Affinity DataIC50:  2.44E+4nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetSentrin-specific protease 8(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM93577(2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [2-...)
Affinity DataIC50:  2.44E+4nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay