BDBM50295871 CHEMBL552002::N-[2-(5-Methoxy-2-{[(4-methoxyphenyl)(methyl)amino]methyl}-1H-indol-3-yl)-ethyl]acetamide

SMILES: COc1ccc(cc1)N(C)Cc1[nH]c2ccc(OC)cc2c1CCNC(C)=O

InChI Key: InChIKey=HQQOJNCZDSKKMT-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50295871   

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 receptor (Homo sapiens (Human))	BDBM50295871 (CHEMBL552002 | N-[2-(5-Methoxy-2-{[(4-methoxypheny...) Show SMILES COc1ccc(cc1)N(C)Cc1[nH]c2ccc(OC)cc2c1CCNC(C)=O Show InChI InChI=1S/C22H27N3O3/c1-15(26)23-12-11-19-20-13-18(28-4)9-10-21(20)24-22(19)14-25(2)16-5-7-17(27-3)8-6-16/h5-10,13,24H,11-12,14H2,1-4H3,(H,23,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of W£rzburg Curated by ChEMBL					Assay Description Displacement of 2-[125I]-iodomelatonin from human MT1 receptor expressed in CHO cells by gamma counting				Bioorg Med Chem 17: 4583-94 (2009) Article DOI: 10.1016/j.bmc.2009.04.068 BindingDB Entry DOI: 10.7270/Q29W0FHG
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM50295871 (CHEMBL552002 | N-[2-(5-Methoxy-2-{[(4-methoxypheny...) Show SMILES COc1ccc(cc1)N(C)Cc1[nH]c2ccc(OC)cc2c1CCNC(C)=O Show InChI InChI=1S/C22H27N3O3/c1-15(26)23-12-11-19-20-13-18(28-4)9-10-21(20)24-22(19)14-25(2)16-5-7-17(27-3)8-6-16/h5-10,13,24H,11-12,14H2,1-4H3,(H,23,26)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of W£rzburg Curated by ChEMBL					Assay Description Displacement of 2-[125I]-iodomelatonin from human MT2 receptor expressed in CHO cells by gamma counting				Bioorg Med Chem 17: 4583-94 (2009) Article DOI: 10.1016/j.bmc.2009.04.068 BindingDB Entry DOI: 10.7270/Q29W0FHG
					More data for this Ligand-Target Pair