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 = 'BDBM50230642'   

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)	BDBM50230642 (CHEMBL282490) Show SMILES C1CN2CCC1C(C2)n1cnnn1 |(12.18,-16.59,;12.18,-18.13,;13.51,-18.81,;12.88,-17.66,;13.9,-17.31,;13.49,-15.82,;14.85,-16.59,;14.85,-18.13,;16.2,-15.82,;17.61,-16.47,;18.81,-15.11,;17.73,-13.71,;16.37,-14.27,)| Show InChI InChI=1S/C8H13N5/c1-3-12-4-2-7(1)8(5-12)13-6-9-10-11-13/h6-8H,1-5H2	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	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Compound was tested in vitro for its binding affinity to muscarinic acetylcholine receptor from rat cortical homogenates using [3H]OXO-M as radioliga...				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)	BDBM50230642 (CHEMBL282490) Show SMILES C1CN2CCC1C(C2)n1cnnn1 |(12.18,-16.59,;12.18,-18.13,;13.51,-18.81,;12.88,-17.66,;13.9,-17.31,;13.49,-15.82,;14.85,-16.59,;14.85,-18.13,;16.2,-15.82,;17.61,-16.47,;18.81,-15.11,;17.73,-13.71,;16.37,-14.27,)| Show InChI InChI=1S/C8H13N5/c1-3-12-4-2-7(1)8(5-12)13-6-9-10-11-13/h6-8H,1-5H2	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	1.15E+5	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Compound was tested in vitro for its binding affinity to muscarinic acetylcholine receptor from rat cortical homogenates using [3H]QNB as radioligand				J Med Chem 35: 1280-90 (1992) BindingDB Entry DOI: 10.7270/Q2G1632Q
					More data for this Ligand-Target Pair