BDBM50333721 2-(2-(3,5-dimethylphenyl)-1-(2-hydroxypropyl)-1H-indol-5-yl)-N-ethyl-2-methylpropanamide::CHEMBL1643719

SMILES: CC(O)Cn1c(cc2cc(ccc12)C(C)(C)C(=O)NCC(F)(F)F)-c1cc(C)cc(C)c1

InChI Key: InChIKey=PNBVISXDLMVWAF-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 = 50333721   

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))	BDBM50333721 (2-(2-(3,5-dimethylphenyl)-1-(2-hydroxypropyl)-1H-i...) Show SMILES CC(O)Cn1c(cc2cc(ccc12)C(C)(C)C(=O)NCC(F)(F)F)-c1cc(C)cc(C)c1 Show InChI InChI=1S/C25H29F3N2O2/c1-15-8-16(2)10-18(9-15)22-12-19-11-20(6-7-21(19)30(22)13-17(3)31)24(4,5)23(32)29-14-25(26,27)28/h6-12,17,31H,13-14H2,1-5H3,(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.17E+3	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