BindingDB logo
myBDB logout

null

SMILES: CC(C)c1cc(NC(=O)c2ccc(Cl)cc2Cl)ccc1O

InChI Key: InChIKey=WBIOTDKSOUMYHK-UHFFFAOYSA-N

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 = 50118075   
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
Bile acid receptor


(Homo sapiens (Human))		BDBM50118075
PNG
(CHEMBL3613420)
Show SMILES CC(C)c1cc(NC(=O)c2ccc(Cl)cc2Cl)ccc1O
Show InChI InChI=1S/C16H15Cl2NO2/c1-9(2)13-8-11(4-6-15(13)20)19-16(21)12-5-3-10(17)7-14(12)18/h3-9,20H,1-2H3,(H,19,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Antagonist activity at GST-tagged FXR LBD (unknown origin) assessed as inhibition of CDCA-induced Bio-SRC-1 recruitment after 30 mins by HTRF assay

Bioorg Med Chem 23: 6427-36 (2015)


BindingDB Entry DOI: 10.7270/Q2GT5Q0T
More data for this
Ligand-Target Pair