Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 408.2 BDBM50538970

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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 M4 (Homo sapiens (Human))	BDBM50538970 (CHEMBL4640242) Show SMILES Cc1n(C)nc2cc(F)c(cc12)C(=O)NC1CN(C1)c1cc(Cl)ncc1Cl Show InChI InChI=1S/C18H16Cl2FN5O/c1-9-11-3-12(14(21)4-15(11)24-25(9)2)18(27)23-10-7-26(8-10)16-5-17(20)22-6-13(16)19/h3-6,10H,7-8H2,1-2H3,(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	739	n/a	n/a	n/a	n/a
Vanderbilt University Curated by ChEMBL					Assay Description Positive allosteric modulation of human muscarinic M4 receptor expressed in CHO cells co-expressing Gqi5 assessed as increase in acetylcholine-induce...				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2019.126812 BindingDB Entry DOI: 10.7270/Q2XD1568
					More data for this Ligand-Target Pair