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BDBM66588 7-(4-chlorobenzyl)-5,8-diketo-1,3,6,8a-tetrahydrothiazolo[3,4-a]pyrazine-3-carboxylic acid methyl ester::7-[(4-chlorophenyl)methyl]-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[3,4-a]pyrazine-3-carboxylic acid methyl ester::MLS000720858::SMR000334213::cid_4663601::methyl 7-(4-chlorobenzyl)-5,8-dioxohexahydro[1,3]thiazolo[3,4-a]pyrazine-3-carboxylate::methyl 7-[(4-chlorophenyl)methyl]-5,8-bis(oxidanylidene)-1,3,6,8a-tetrahydro-[1,3]thiazolo[3,4-a]pyrazine-3-carboxylate::methyl 7-[(4-chlorophenyl)methyl]-5,8-dioxo-1,3,6,8a-tetrahydro-[1,3]thiazolo[3,4-a]pyrazine-3-carboxylate

SMILES: COC(=O)C1SCC2N1C(=O)CN(Cc1ccc(Cl)cc1)C2=O

InChI Key: InChIKey=AIYOKMAJJCJQGW-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 66588   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bcl-2-like protein 11


(Homo sapiens (Human))
BDBM66588
PNG
(7-(4-chlorobenzyl)-5,8-diketo-1,3,6,8a-tetrahydrot...)
Show SMILES COC(=O)C1SCC2N1C(=O)CN(Cc1ccc(Cl)cc1)C2=O
Show InChI InChI=1S/C15H15ClN2O4S/c1-22-15(21)14-18-11(8-23-14)13(20)17(7-12(18)19)6-9-2-4-10(16)5-3-9/h2-5,11,14H,6-8H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>3.50E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24J0CKJ
More data for this
Ligand-Target Pair