BDBM50037245 CHEMBL288300::Heptanoic acid [2-(7-methoxy-naphthalen-1-yl)-ethyl]-amide

SMILES: CCCCCCC(=O)NCCc1cccc2ccc(OC)cc12

InChI Key: InChIKey=GGUICPRYMICIBA-UHFFFAOYSA-N

Data: 2 IC50  2 Kd

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 4 hits for monomerid = 50037245   

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))	BDBM50037245 (CHEMBL288300 | Heptanoic acid [2-(7-methoxy-naphth...) Show SMILES CCCCCCC(=O)NCCc1cccc2ccc(OC)cc12 Show InChI InChI=1S/C20H27NO2/c1-3-4-5-6-10-20(22)21-14-13-17-9-7-8-16-11-12-18(23-2)15-19(16)17/h7-9,11-12,15H,3-6,10,13-14H2,1-2H3,(H,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia 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
Universit£ d'Orl£ans Curated by ChEMBL					Assay Description Melatonin receptor type 1A binding affinity measured using 2-[125I]iodomelatonin on ovine pars tuberalis membrane homogenates.				J Med Chem 41: 4453-65 (1998) Article DOI: 10.1021/jm980026p BindingDB Entry DOI: 10.7270/Q2B27WHJ
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM50037245 (CHEMBL288300 | Heptanoic acid [2-(7-methoxy-naphth...) Show SMILES CCCCCCC(=O)NCCc1cccc2ccc(OC)cc12 Show InChI InChI=1S/C20H27NO2/c1-3-4-5-6-10-20(22)21-14-13-17-9-7-8-16-11-12-18(23-2)15-19(16)17/h7-9,11-12,15H,3-6,10,13-14H2,1-2H3,(H,21,22)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Chimie Pharmaceutique Curated by ChEMBL					Assay Description Monophasic inhibitory concentration against melatonin receptor was measured on ovine pars tuberalis membrane.				J Med Chem 37: 3231-9 (1994) Article DOI: 10.1021/jm00046a006 BindingDB Entry DOI: 10.7270/Q2S75K1J
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM50037245 (CHEMBL288300 | Heptanoic acid [2-(7-methoxy-naphth...) Show SMILES CCCCCCC(=O)NCCc1cccc2ccc(OC)cc12 Show InChI InChI=1S/C20H27NO2/c1-3-4-5-6-10-20(22)21-14-13-17-9-7-8-16-11-12-18(23-2)15-19(16)17/h7-9,11-12,15H,3-6,10,13-14H2,1-2H3,(H,21,22)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a
Institut de Chimie Pharmaceutique Curated by ChEMBL					Assay Description Binding affinity to melatonin receptor measured on ovine pars tuberalis membrane				J Med Chem 37: 3231-9 (1994) Article DOI: 10.1021/jm00046a006 BindingDB Entry DOI: 10.7270/Q2S75K1J
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM50037245 (CHEMBL288300 | Heptanoic acid [2-(7-methoxy-naphth...) Show SMILES CCCCCCC(=O)NCCc1cccc2ccc(OC)cc12 Show InChI InChI=1S/C20H27NO2/c1-3-4-5-6-10-20(22)21-14-13-17-9-7-8-16-11-12-18(23-2)15-19(16)17/h7-9,11-12,15H,3-6,10,13-14H2,1-2H3,(H,21,22)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a
Universite de Lille Curated by ChEMBL					Assay Description Binding affinity against Melatonin receptor using ovine pars tuberalis membranes of the pituitary.				J Med Chem 35: 1484-6 (1992) BindingDB Entry DOI: 10.7270/Q2B85BB0
					More data for this Ligand-Target Pair