BDBM50135218 CHEMBL3747781

SMILES: O[C@H]1COCC[C@@H]1NC(=O)c1cn(Cc2ccc(cc2)-c2cc[nH]n2)c2cccnc12

InChI Key: InChIKey=DVQIVEMLCDIXIH-FPOVZHCZSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50135218   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50135218 (CHEMBL3747781) Show SMILES O[C@H]1COCC[C@@H]1NC(=O)c1cn(Cc2ccc(cc2)-c2cc[nH]n2)c2cccnc12 |r| Show InChI InChI=1S/C23H23N5O3/c29-21-14-31-11-8-19(21)26-23(30)17-13-28(20-2-1-9-24-22(17)20)12-15-3-5-16(6-4-15)18-7-10-25-27-18/h1-7,9-10,13,19,21,29H,8,11-12,14H2,(H,25,27)(H,26,30)/t19-,21-/m0/s1	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	77	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Positive allosteric modulation of human muscarinic M1 receptor expressed in CHO cells assessed as increase in ACh-induced intracellular calcium level...				Bioorg Med Chem Lett 28: 2068-2073 (2018) Article DOI: 10.1016/j.bmcl.2018.04.054 BindingDB Entry DOI: 10.7270/Q2TB19HB
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM50135218 (CHEMBL3747781) Show SMILES O[C@H]1COCC[C@@H]1NC(=O)c1cn(Cc2ccc(cc2)-c2cc[nH]n2)c2cccnc12 |r| Show InChI InChI=1S/C23H23N5O3/c29-21-14-31-11-8-19(21)26-23(30)17-13-28(20-2-1-9-24-22(17)20)12-15-3-5-16(6-4-15)18-7-10-25-27-18/h1-7,9-10,13,19,21,29H,8,11-12,14H2,(H,25,27)(H,26,30)/t19-,21-/m0/s1	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	65	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Positive allosteric modulation of human M1 receptor expressed in CHO cells assessed as acetylcholine-induced calcium mobilization by FLIPR assay				Bioorg Med Chem Lett 26: 650-5 (2016) BindingDB Entry DOI: 10.7270/Q29C708F
					More data for this Ligand-Target Pair