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SMILES: CC(C)n1cnnc1-c1cccc(NC(=O)c2cc(C3CC3C(=O)NC3CC3)c(C)cc2F)n1

InChI Key: InChIKey=PCDQBTLNYUKRND-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 490077   
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))		BDBM490077
PNG
(US10968199, Example 3)
Show SMILES CC(C)n1cnnc1-c1cccc(NC(=O)c2cc(C3CC3C(=O)NC3CC3)c(C)cc2F)n1
Show InChI InChI=1S/C25H27FN6O2/c1-13(2)32-12-27-31-23(32)21-5-4-6-22(29-21)30-25(34)19-10-16(14(3)9-20(19)26)17-11-18(17)24(33)28-15-7-8-15/h4-6,9-10,12-13,15,17-18H,7-8,11H2,1-3H3,(H,28,33)(H,29,30,34)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>10n/an/an/an/an/an/a



Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE™ Assay System was obtained f...

US Patent US10968199 (2021)


BindingDB Entry DOI: 10.7270/Q28W3HDS
More data for this
Ligand-Target Pair