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BDBM50135217 CHEMBL3746869

SMILES: Cc1ccnc2c(cn(Cc3ccc(cc3)-c3ccn(C)n3)c12)C(=O)N[C@H]1CCOC[C@@H]1O

InChI Key: InChIKey=DSAMNLHUPHEPGE-VXKWHMMOSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50135217   
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))		BDBM50135217
PNG
(CHEMBL3746869)
Show SMILES Cc1ccnc2c(cn(Cc3ccc(cc3)-c3ccn(C)n3)c12)C(=O)N[C@H]1CCOC[C@@H]1O |r|
Show InChI InChI=1S/C25H27N5O3/c1-16-7-10-26-23-19(25(32)27-21-9-12-33-15-22(21)31)14-30(24(16)23)13-17-3-5-18(6-4-17)20-8-11-29(2)28-20/h3-8,10-11,14,21-22,31H,9,12-13,15H2,1-2H3,(H,27,32)/t21-,22-/m0/s1
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UniProtKB/TrEMBL

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Similars
PubMed
n/an/an/an/a 9n/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