Reaction Details Report a problem with these data
Target
Cathepsin B
Ligand
BDBM41100
Substrate
n/a
Meas. Tech.
Cathepsin B dose-response confirmation
IC50
19686.4±499.7 nM
Citation
 PubChem, PC Cathepsin B dose-response confirmation PubChem Bioassay (2008)[AID] 
Target
Name:
Cathepsin B
Synonyms:
APP secretase | APPS | CATB_HUMAN | CPSB | CTSB | Cathepsin B heavy chain | Cathepsin B light chain | Cathepsin B1
Type:
Enzyme
Mol. Mass.:
37819.69
Organism:
Homo sapiens (Human)
Description:
gi_63102437
Residue:
339
Sequence:
MWQLWASLCCLLVLANARSRPSFHPLSDELVNYVNKRNTTWQAGHNFYNVDMSYLKRLCGTFLGGPKPPQRVMFTEDLKLPASFDAREQWPQCPTIKEIRDQGSCGSCWAFGAVEAISDRICIHTNAHVSVEVSAEDLLTCCGSMCGDGCNGGYPAEAWNFWTRKGLVSGGLYESHVGCRPYSIPPCEHHVNGSRPPCTGEGDTPKCSKICEPGYSPTYKQDKHYGYNSYSVSNSEKDIMAEIYKNGPVEGAFSVYSDFLLYKSGVYQHVTGEMMGGHAIRILGWGVENGTPYWLVANSWNTDWGDNGFFKILRGQDHCGIESEVVAGIPRTDQYWEKI
  
Inhibitor
Name:
BDBM41100
Synonyms:
2-[cyano-[4-(dimethylamino)-6-(methylthio)-1,3,5-triazin-2-yl]amino]propanedioic acid diethyl ester | 2-[cyano-[4-(dimethylamino)-6-(methylthio)-s-triazin-2-yl]amino]malonic acid diethyl ester | MLS000080173 | SMR000039053 | cid_658152 | diethyl 2-[cyano-[4-(dimethylamino)-6-methylsulfanyl-1,3,5-triazin-2-yl]amino]propanedioate
Type:
Small organic molecule
Emp. Form.:
C14H20N6O4S
Mol. Mass.:
368.411
SMILES:
CCOC(=O)C(N(C#N)c1nc(SC)nc(n1)N(C)C)C(=O)OCC
Structure:
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