BDBM50014317 CHEMBL3260895

SMILES: CCOC(=O)C1=C(C)NC(=CC1c1ccccc1[N+]([O-])=O)c1ccc(C)cc1

InChI Key: InChIKey=GRIPLABMJDOAPW-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 = 50014317   

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 (Homo sapiens (Human))	BDBM50014317 (CHEMBL3260895) Show SMILES CCOC(=O)C1=C(C)NC(=CC1c1ccccc1[N+]([O-])=O)c1ccc(C)cc1 |c:5,9| Show InChI InChI=1S/C22H22N2O4/c1-4-28-22(25)21-15(3)23-19(16-11-9-14(2)10-12-16)13-18(21)17-7-5-6-8-20(17)24(26)27/h5-13,18,23H,4H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Complutense Curated by ChEMBL					Assay Description Inhibition of human Cav1.3 channel in human SH-SY5Y cells assessed as 70 mM K+ induced calcium elevation compound treated 15 mins before stimulus by ...				J Med Chem 57: 4313-23 (2014) Article DOI: 10.1021/jm500263v BindingDB Entry DOI: 10.7270/Q22R3T6K
					More data for this Ligand-Target Pair