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SMILES: C[C@@H](CO)n1cnnc1-c1cccc(n1)N1Cc2ccccc2C1=O

InChI Key: InChIKey=UWTNXYBYBHTZRY-LBPRGKRZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50212278   
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
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM50212278
PNG
(CHEMBL3934521)
Show SMILES C[C@@H](CO)n1cnnc1-c1cccc(n1)N1Cc2ccccc2C1=O |r|
Show InChI InChI=1S/C18H17N5O2/c1-12(10-24)23-11-19-21-17(23)15-7-4-8-16(20-15)22-9-13-5-2-3-6-14(13)18(22)25/h2-8,11-12,24H,9-10H2,1H3/t12-/m0/s1
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Article
PubMed
n/an/a 32n/an/an/an/an/an/a



Takeda Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal GST-tagged ASK1 catalytic domain (654 to 971 residues) expressed in baculovirus infected sf21 cells using ...

ACS Med Chem Lett 8: 316-320 (2017)


Article DOI: 10.1021/acsmedchemlett.6b00481
BindingDB Entry DOI: 10.7270/Q2BC41QV
More data for this
Ligand-Target Pair