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BDBM50135199 CHEMBL3747166

SMILES: O[C@H]1COCC[C@@H]1NC(=O)c1cn(Cc2ccc(cc2)-n2cccn2)c2cccnc12

InChI Key: InChIKey=SLELEIAPYGGKBT-FPOVZHCZSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50135199   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))		BDBM50135199
PNG
(CHEMBL3747166)
Show SMILES O[C@H]1COCC[C@@H]1NC(=O)c1cn(Cc2ccc(cc2)-n2cccn2)c2cccnc12 |r|
Show InChI InChI=1S/C23H23N5O3/c29-21-15-31-12-8-19(21)26-23(30)18-14-27(20-3-1-9-24-22(18)20)13-16-4-6-17(7-5-16)28-11-2-10-25-28/h1-7,9-11,14,19,21,29H,8,12-13,15H2,(H,26,30)/t19-,21-/m0/s1
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/an/a 63n/an/an/an/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