Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Melatonin receptor type 1A/1B' and Ligand = 'BDBM50045584'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Melatonin receptor type 1A/1B (Homo sapiens (Human))	BDBM50045584 (CHEMBL3309941) Show SMILES [H][C@@]12Cc3cc(Cl)c(OC)cc3[C@@]1([H])N(CCC2)C(C)=O |r| Show InChI InChI=1S/C15H18ClNO2/c1-9(18)17-5-3-4-10-6-11-7-13(16)14(19-2)8-12(11)15(10)17/h7-8,10,15H,3-6H2,1-2H3/t10-,15+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Valencia Curated by ChEMBL					Assay Description Displacement of [125L]iodomelatonin from human MT2 receptor expressed in HEK293 cells				Bioorg Med Chem Lett 24: 3534-6 (2014) Article DOI: 10.1016/j.bmcl.2014.05.053 BindingDB Entry DOI: 10.7270/Q28G8NB9
					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Homo sapiens (Human))	BDBM50045584 (CHEMBL3309941) Show SMILES [H][C@@]12Cc3cc(Cl)c(OC)cc3[C@@]1([H])N(CCC2)C(C)=O |r| Show InChI InChI=1S/C15H18ClNO2/c1-9(18)17-5-3-4-10-6-11-7-13(16)14(19-2)8-12(11)15(10)17/h7-8,10,15H,3-6H2,1-2H3/t10-,15+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Valencia Curated by ChEMBL					Assay Description Displacement of [125L]iodomelatonin from human MT1 receptor expressed in HEK293 cells				Bioorg Med Chem Lett 24: 3534-6 (2014) Article DOI: 10.1016/j.bmcl.2014.05.053 BindingDB Entry DOI: 10.7270/Q28G8NB9
					More data for this Ligand-Target Pair