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SMILES: Clc1ccc(cc1)-c1nc2ccccc2n1C(C1CCOCC1)C(=O)NC1CCCCC1

InChI Key: InChIKey=ABDCDPWCDDPIKP-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50334245   
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))		BDBM50334245
PNG
(2-(2-(4-chlorophenyl)-1H-benzo[d]imidazol-1-yl)-N-...)
Show SMILES Clc1ccc(cc1)-c1nc2ccccc2n1C(C1CCOCC1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C26H30ClN3O2/c27-20-12-10-19(11-13-20)25-29-22-8-4-5-9-23(22)30(25)24(18-14-16-32-17-15-18)26(31)28-21-6-2-1-3-7-21/h4-5,8-13,18,21,24H,1-3,6-7,14-17H2,(H,28,31)
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Similars
Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



F Hoffmann-La Roche AG

Curated by ChEMBL


Assay Description
Displacement of radioligand from human FXR by scintillation proximity assay

Bioorg Med Chem Lett 21: 191-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.039
BindingDB Entry DOI: 10.7270/Q2XP757R
More data for this
Ligand-Target Pair