BDBM50178453 6-(4-ethoxyphenyl)-N,4,5,7-tetramethyl-N-(2-(pyridin-2-yl)ethyl)-6H-pyrrolo[3,4-d]pyridazin-1-amine::CHEMBL201100

SMILES: CCOc1ccc(cc1)-n1c(C)c2c(C)nnc(N(C)CCc3ccccn3)c2c1C

InChI Key: InChIKey=ASEXCKNPGKEBKX-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 = 50178453   

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))	BDBM50178453 (6-(4-ethoxyphenyl)-N,4,5,7-tetramethyl-N-(2-(pyrid...) Show SMILES CCOc1ccc(cc1)-n1c(C)c2c(C)nnc(N(C)CCc3ccccn3)c2c1C Show InChI InChI=1S/C25H29N5O/c1-6-31-22-12-10-21(11-13-22)30-18(3)23-17(2)27-28-25(24(23)19(30)4)29(5)16-14-20-9-7-8-15-26-20/h7-13,15H,6,14,16H2,1-5H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	179	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description [3H]Gabapentin binding in human A710 membrane expressing alpha2delta subunit of calcium channel				Bioorg Med Chem Lett 16: 746-9 (2005) Article DOI: 10.1016/j.bmcl.2005.08.117 BindingDB Entry DOI: 10.7270/Q2X34X2M
					More data for this Ligand-Target Pair