BindingDB logo
myBDB logout

BDBM50369609 CHEMBL120351

SMILES: CN(C(=O)C(C)(C)C)c1ccccc1SSc1ccccc1N(C)C(=O)C(C)(C)C

InChI Key: InChIKey=JOGKYLUUTCEDQV-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50369609   
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
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50369609
PNG
(CHEMBL120351)
Show SMILES CN(C(=O)C(C)(C)C)c1ccccc1SSc1ccccc1N(C)C(=O)C(C)(C)C
Show InChI InChI=1S/C24H32N2O2S2/c1-23(2,3)21(27)25(7)17-13-9-11-15-19(17)29-30-20-16-12-10-14-18(20)26(8)22(28)24(4,5)6/h9-16H,1-8H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a>3.00E+5n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
In vitro concentration required to inhibit 50% of cholesteryl ester transfer protein mediated cholesteryl ester transfer from HDL to VLDL and LDL in ...


J Med Chem 43: 3566-72 (2000)


BindingDB Entry DOI: 10.7270/Q22J6CK6
More data for this
Ligand-Target Pair