BDBM50142200 CHEMBL266549::N-{4-[(3-Methoxy-phenyl)-methyl-amino]-phenyl}-butyramide

SMILES: CCCC(=O)Nc1ccc(cc1)N(C)c1cccc(OC)c1

InChI Key: InChIKey=NQUDJLRSETYURD-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 = 50142200   

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))	BDBM50142200 (CHEMBL266549 | N-{4-[(3-Methoxy-phenyl)-methyl-ami...) Show SMILES CCCC(=O)Nc1ccc(cc1)N(C)c1cccc(OC)c1 Show InChI InChI=1S/C18H22N2O2/c1-4-6-18(21)19-14-9-11-15(12-10-14)20(2)16-7-5-8-17(13-16)22-3/h5,7-13H,4,6H2,1-3H3,(H,19,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity towards human melatonin receptor type 1B				Bioorg Med Chem Lett 14: 1023-6 (2004) Article DOI: 10.1016/j.bmcl.2003.11.030 BindingDB Entry DOI: 10.7270/Q2HT2NSG
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM50142200 (CHEMBL266549 | N-{4-[(3-Methoxy-phenyl)-methyl-ami...) Show SMILES CCCC(=O)Nc1ccc(cc1)N(C)c1cccc(OC)c1 Show InChI InChI=1S/C18H22N2O2/c1-4-6-18(21)19-14-9-11-15(12-10-14)20(2)16-7-5-8-17(13-16)22-3/h5,7-13H,4,6H2,1-3H3,(H,19,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity towards human melatonin receptor type 1A				Bioorg Med Chem Lett 14: 1023-6 (2004) Article DOI: 10.1016/j.bmcl.2003.11.030 BindingDB Entry DOI: 10.7270/Q2HT2NSG
					More data for this Ligand-Target Pair