BDBM50315171 CHEMBL1092646::N-(3-(5-methoxy-2-(3-methoxybenzyloxy)phenyl)propyl)acetamide

SMILES COc1cccc(COc2ccc(OC)cc2CCCNC(C)=O)c1

InChI Key InChIKey=BXVNHHHDHBAPPO-UHFFFAOYSA-N

Data  2 KI

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50315171   

TargetMelatonin receptor type 1B(Homo sapiens (Human))
Hong Kong University of Science and Technology

Curated by ChEMBL
LigandPNGBDBM50315171(CHEMBL1092646 | N-(3-(5-methoxy-2-(3-methoxybenzyl...)
Show SMILES COc1cccc(COc2ccc(OC)cc2CCCNC(C)=O)c1
Show InChI InChI=1S/C20H25NO4/c1-15(22)21-11-5-7-17-13-19(24-3)9-10-20(17)25-14-16-6-4-8-18(12-16)23-2/h4,6,8-10,12-13H,5,7,11,14H2,1-3H3,(H,21,22)
Affinity DataKi:  0.000690nMAssay Description:Displacement of [3H]melatonin from human melatonin MT2 receptor expressed in CHO cells after 60 mins by scintillation countingMore data for this Ligand-Target Pair
TargetMelatonin receptor type 1A(Homo sapiens (Human))
Hong Kong University of Science and Technology

Curated by ChEMBL
LigandPNGBDBM50315171(CHEMBL1092646 | N-(3-(5-methoxy-2-(3-methoxybenzyl...)
Show SMILES COc1cccc(COc2ccc(OC)cc2CCCNC(C)=O)c1
Show InChI InChI=1S/C20H25NO4/c1-15(22)21-11-5-7-17-13-19(24-3)9-10-20(17)25-14-16-6-4-8-18(12-16)23-2/h4,6,8-10,12-13H,5,7,11,14H2,1-3H3,(H,21,22)
Affinity DataKi:  441nMAssay Description:Displacement of [3H]melatonin from human melatonin MT1 receptor expressed in CHO cells after 60 mins by scintillation countingMore data for this Ligand-Target Pair