BDBM50411361 CHEMBL396991

SMILES: CC(=O)NCC(C)(C)c1cn2CCCc3cccc1c23

InChI Key: InChIKey=KXGSDNCPIZBEDE-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 = 50411361   

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
Melatonin 1C (Xenopus)	BDBM50411361 (CHEMBL396991) Show SMILES CC(=O)NCC(C)(C)c1cn2CCCc3cccc1c23 Show InChI InChI=1S/C17H22N2O/c1-12(20)18-11-17(2,3)15-10-19-9-5-7-13-6-4-8-14(15)16(13)19/h4,6,8,10H,5,7,9,11H2,1-3H3,(H,18,20)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Athens Curated by ChEMBL					Assay Description Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins				Eur J Med Chem 42: 1004-13 (2007) Article DOI: 10.1016/j.ejmech.2007.01.005 BindingDB Entry DOI: 10.7270/Q2B859BK
					More data for this Ligand-Target Pair