BDBM50145331 CHEMBL309198::{2-Methyl-1-[6-(3-trifluoromethyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yloxymethyl)-pyridin-2-yl]-propyl}-phenethyl-amine

SMILES: CC(C)C(NCCc1ccccc1)c1cccc(COc2nn3c(nnc3c3ccccc23)C(F)(F)F)n1

InChI Key: InChIKey=IASHEURKZFQDMZ-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 = 50145331   

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-dependent calcium channel subunit alpha-2/delta-1 (Homo sapiens (Human))	BDBM50145331 (CHEMBL309198 | {2-Methyl-1-[6-(3-trifluoromethyl-[...) Show SMILES CC(C)C(NCCc1ccccc1)c1cccc(COc2nn3c(nnc3c3ccccc23)C(F)(F)F)n1 Show InChI InChI=1S/C28H27F3N6O/c1-18(2)24(32-16-15-19-9-4-3-5-10-19)23-14-8-11-20(33-23)17-38-26-22-13-7-6-12-21(22)25-34-35-27(28(29,30)31)37(25)36-26/h3-14,18,24,32H,15-17H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	174	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity against alpha2 delta-1 subunit of voltage-gated calcium channel in human.				Bioorg Med Chem Lett 14: 2463-7 (2004) Article DOI: 10.1016/j.bmcl.2004.03.008 BindingDB Entry DOI: 10.7270/Q23X876G
					More data for this Ligand-Target Pair