BDBM50118461 CHEMBL424641::N-[2-(6,7-Dimethoxy-indan-1-yl)-ethyl]-acetamide

SMILES: COc1ccc2CCC(CCNC(C)=O)c2c1OC

InChI Key: InChIKey=SUFURHDHUKPCGZ-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 = 50118461   

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))	BDBM50118461 (CHEMBL424641 | N-[2-(6,7-Dimethoxy-indan-1-yl)-eth...) Show SMILES COc1ccc2CCC(CCNC(C)=O)c2c1OC Show InChI InChI=1S/C15H21NO3/c1-10(17)16-9-8-12-5-4-11-6-7-13(18-2)15(19-3)14(11)12/h6-7,12H,4-5,8-9H2,1-3H3,(H,16,17)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	47	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Chemical Industries, Ltd. Curated by ChEMBL					Assay Description Ability to inhibit 2-[125I]iodomelatonin specific binding to human melatonin receptor type 1A (MT1) expressed in CHO cells.				J Med Chem 45: 4212-21 (2002) BindingDB Entry DOI: 10.7270/Q2J102HG
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50118461 (CHEMBL424641 | N-[2-(6,7-Dimethoxy-indan-1-yl)-eth...) Show SMILES COc1ccc2CCC(CCNC(C)=O)c2c1OC Show InChI InChI=1S/C15H21NO3/c1-10(17)16-9-8-12-5-4-11-6-7-13(18-2)15(19-3)14(11)12/h6-7,12H,4-5,8-9H2,1-3H3,(H,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	3.15E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Chemical Industries, Ltd. Curated by ChEMBL					Assay Description Ability to inhibit 2-[125I]iodomelatonin specific binding to melatonin receptor 3 (MT3) of Syrian hamster brain.				J Med Chem 45: 4212-21 (2002) BindingDB Entry DOI: 10.7270/Q2J102HG
					More data for this Ligand-Target Pair