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SMILES: OCCCn1ccc2c(cccc12)C1=C(C(=O)NC1=O)c1cn2CCNCc3cccc1c23

InChI Key: InChIKey=YJRCJVQGBKVXBL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50474998   
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
Glycogen synthase kinase-3


(Homo sapiens (Human))		BDBM50474998
PNG
(CHEMBL182048)
Show SMILES OCCCn1ccc2c(cccc12)C1=C(C(=O)NC1=O)c1cn2CCNCc3cccc1c23 |t:15|
Show InChI InChI=1S/C26H24N4O3/c31-13-3-10-29-11-8-17-18(5-2-7-21(17)29)22-23(26(33)28-25(22)32)20-15-30-12-9-27-14-16-4-1-6-19(20)24(16)30/h1-2,4-8,11,15,27,31H,3,9-10,12-14H2,(H,28,32,33)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 27n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against the Glycogen synthase kinase-3

Bioorg Med Chem Lett 15: 899-903 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.063
BindingDB Entry DOI: 10.7270/Q2H70JJG
More data for this
Ligand-Target Pair