Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M1/M2/M3/M4/M5' and Ligand = 'BDBM50230645'   

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/M2/M3/M4/M5 (RAT)	BDBM50230645 (CHEMBL434772) Show SMILES Cc1cnn(n1)C1CN2CCC1CC2 |(18.13,-12.97,;17.74,-14.43,;18.81,-15.82,;17.59,-17.15,;16.19,-16.54,;16.36,-14.97,;14.84,-17.3,;14.84,-18.84,;13.5,-19.51,;12.17,-18.84,;12.17,-17.3,;13.5,-16.52,;13.89,-18,;12.87,-18.35,)| Show InChI InChI=1S/C10H16N4/c1-8-6-11-14(12-8)10-7-13-4-2-9(10)3-5-13/h6,9-10H,2-5,7H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description In vitro inhibition of [3H]OXO-M binding to Muscarinic receptor from rat cortical homogenates				J Med Chem 35: 1280-90 (1992) BindingDB Entry DOI: 10.7270/Q2G1632Q
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5 (RAT)	BDBM50230645 (CHEMBL434772) Show SMILES Cc1cnn(n1)C1CN2CCC1CC2 |(18.13,-12.97,;17.74,-14.43,;18.81,-15.82,;17.59,-17.15,;16.19,-16.54,;16.36,-14.97,;14.84,-17.3,;14.84,-18.84,;13.5,-19.51,;12.17,-18.84,;12.17,-17.3,;13.5,-16.52,;13.89,-18,;12.87,-18.35,)| Show InChI InChI=1S/C10H16N4/c1-8-6-11-14(12-8)10-7-13-4-2-9(10)3-5-13/h6,9-10H,2-5,7H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description In vitro inhibition of [3H]QNB binding to Muscarinic receptor from rat cortical homogenates				J Med Chem 35: 1280-90 (1992) BindingDB Entry DOI: 10.7270/Q2G1632Q
					More data for this Ligand-Target Pair