BDBM50333703 CHEMBL1643724::N-tert-butyl-2-(1-(2-(tert-butylamino)-2-oxoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl)-2-methylpropanamide

SMILES: Cc1cc(C)cc(c1)-c1cc2cc(ccc2n1CC(=O)NC(C)(C)C)C(C)(C)C(=O)NC(C)(C)C

InChI Key: InChIKey=LNRCOYGFXLOJIM-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 2 hits for monomerid = 50333703   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Voltage-gated calcium channel subunit alpha Cav2.2 (Homo sapiens (Human))	BDBM50333703 (CHEMBL1643724 | N-tert-butyl-2-(1-(2-(tert-butylam...) Show SMILES Cc1cc(C)cc(c1)-c1cc2cc(ccc2n1CC(=O)NC(C)(C)C)C(C)(C)C(=O)NC(C)(C)C Show InChI InChI=1S/C30H41N3O2/c1-19-13-20(2)15-21(14-19)25-17-22-16-23(30(9,10)27(35)32-29(6,7)8)11-12-24(22)33(25)18-26(34)31-28(3,4)5/h11-17H,18H2,1-10H3,(H,31,34)(H,32,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Blockade of Cav2.2 channel by fluorescent calcium-influx assay				Bioorg Med Chem Lett 21: 869-73 (2011) Article DOI: 10.1016/j.bmcl.2010.11.067 BindingDB Entry DOI: 10.7270/Q2B27VJK
					More data for this Ligand-Target Pair
Pregnane X receptor (Homo sapiens (Human))	BDBM50333703 (CHEMBL1643724 | N-tert-butyl-2-(1-(2-(tert-butylam...) Show SMILES Cc1cc(C)cc(c1)-c1cc2cc(ccc2n1CC(=O)NC(C)(C)C)C(C)(C)C(=O)NC(C)(C)C Show InChI InChI=1S/C30H41N3O2/c1-19-13-20(2)15-21(14-19)25-17-22-16-23(30(9,10)27(35)32-29(6,7)8)11-12-24(22)33(25)18-26(34)31-28(3,4)5/h11-17H,18H2,1-10H3,(H,31,34)(H,32,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Activity at PXR by induction assay				Bioorg Med Chem Lett 21: 869-73 (2011) Article DOI: 10.1016/j.bmcl.2010.11.067 BindingDB Entry DOI: 10.7270/Q2B27VJK
					More data for this Ligand-Target Pair