Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with all data for entry = 50005464   

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
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM50492269 (CHEMBL594432) Show SMILES COc1ccc(Cn2cc(C(O)=O)c(=O)c3c(F)ccc(F)c23)cc1 Show InChI InChI=1S/C18H13F2NO4/c1-25-11-4-2-10(3-5-11)8-21-9-12(18(23)24)17(22)15-13(19)6-7-14(20)16(15)21/h2-7,9H,8H2,1H3,(H,23,24)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	32	n/a	n/a	n/a	n/a
Monash University Curated by ChEMBL					Assay Description Allosteric modulation of human muscarinic M1 acetylcholine receptor expressed CHO cells assessed as intracellular calcium mobilization after 1 hr by ...				J Med Chem 56: 5151-72 (2013) Article DOI: 10.1021/jm400540b BindingDB Entry DOI: 10.7270/Q2WS8X52
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM50313638 (1-(4-methoxybenzyl)-4-oxo-1,4-dihydroquinoline-3-c...) Show SMILES COc1ccc(Cn2cc(C(O)=O)c(=O)c3ccccc23)cc1 Show InChI InChI=1S/C18H15NO4/c1-23-13-8-6-12(7-9-13)10-19-11-15(18(21)22)17(20)14-4-2-3-5-16(14)19/h2-9,11H,10H2,1H3,(H,21,22)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	129	n/a	n/a	n/a	n/a
Monash University Curated by ChEMBL					Assay Description Allosteric modulation of human muscarinic M1 acetylcholine receptor expressed CHO cells assessed as intracellular calcium mobilization after 1 hr by ...				J Med Chem 56: 5151-72 (2013) Article DOI: 10.1021/jm400540b BindingDB Entry DOI: 10.7270/Q2WS8X52
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM50492269 (CHEMBL594432) Show SMILES COc1ccc(Cn2cc(C(O)=O)c(=O)c3c(F)ccc(F)c23)cc1 Show InChI InChI=1S/C18H13F2NO4/c1-25-11-4-2-10(3-5-11)8-21-9-12(18(23)24)17(22)15-13(19)6-7-14(20)16(15)21/h2-7,9H,8H2,1H3,(H,23,24)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.80	n/a	n/a	n/a	n/a
Monash University Curated by ChEMBL					Assay Description Agonist activity at human muscarinic M1 acetylcholine receptor expressed CHO cells assessed as intracellular calcium mobilization after 1 hr by Fluo-...				J Med Chem 56: 5151-72 (2013) Article DOI: 10.1021/jm400540b BindingDB Entry DOI: 10.7270/Q2WS8X52
					More data for this Ligand-Target Pair