BDBM50145319 (R)-((S)-2-Phenyl-cyclopropyl)-[6-(3-trifluoromethyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yloxymethyl)-pyridin-2-ylmethyl]-amine::CHEMBL310316

SMILES: FC(F)(F)c1nnc2c3ccccc3c(OCc3cccc(CNC4C[C@H]4c4ccccc4)n3)nn12

InChI Key: InChIKey=IVYSDYCKRHRTJP-HMTLIYDFSA-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 = 50145319   

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))	BDBM50145319 ((R)-((S)-2-Phenyl-cyclopropyl)-[6-(3-trifluorometh...) Show SMILES FC(F)(F)c1nnc2c3ccccc3c(OCc3cccc(CNC4C[C@H]4c4ccccc4)n3)nn12 Show InChI InChI=1S/C26H21F3N6O/c27-26(28,29)25-33-32-23-19-11-4-5-12-20(19)24(34-35(23)25)36-15-18-10-6-9-17(31-18)14-30-22-13-21(22)16-7-2-1-3-8-16/h1-12,21-22,30H,13-15H2/t21-,22?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	229	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