null

SMILES: Cc1n(nc2c(nnc(C)c12)N1CCCC1)-c1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=IHJFGPKQEKFKLS-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50348469   

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-2 (Homo sapiens (Human))	BDBM50348469 (CHEMBL1801181) Show SMILES Cc1n(nc2c(nnc(C)c12)N1CCCC1)-c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C18H18F3N5O/c1-11-15-12(2)26(13-5-7-14(8-6-13)27-18(19,20)21)24-16(15)17(23-22-11)25-9-3-4-10-25/h5-8H,3-4,9-10H2,1-2H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Binding affinity at voltage-gated calcium channel subunit alpha2delta2				Bioorg Med Chem Lett 20: 4683-8 (2010) Article DOI: 10.1016/j.bmcl.2010.05.026 BindingDB Entry DOI: 10.7270/Q2GQ6Z3D
					More data for this Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (Homo sapiens (Human))	BDBM50348469 (CHEMBL1801181) Show SMILES Cc1n(nc2c(nnc(C)c12)N1CCCC1)-c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C18H18F3N5O/c1-11-15-12(2)26(13-5-7-14(8-6-13)27-18(19,20)21)24-16(15)17(23-22-11)25-9-3-4-10-25/h5-8H,3-4,9-10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Binding affinity at voltage-gated calcium channel subunit alpha2delta1				Bioorg Med Chem Lett 20: 4683-8 (2010) Article DOI: 10.1016/j.bmcl.2010.05.026 BindingDB Entry DOI: 10.7270/Q2GQ6Z3D
					More data for this Ligand-Target Pair