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SMILES: COc1cc2CN(C)S(=O)(=O)c2cc1C(=O)Nc1cccc(n1)-c1nncn1C(C)C

InChI Key: InChIKey=RRZTUZZKRQBPKZ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 445496   
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))		BDBM445496
PNG
(US10683289, Example 16)
Show SMILES COc1cc2CN(C)S(=O)(=O)c2cc1C(=O)Nc1cccc(n1)-c1nncn1C(C)C
Show InChI InChI=1S/C20H22N6O4S/c1-12(2)26-11-21-24-19(26)15-6-5-7-18(22-15)23-20(27)14-9-17-13(8-16(14)30-4)10-25(3)31(17,28)29/h5-9,11-12H,10H2,1-4H3,(H,22,23,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a<1n/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...

US Patent US10683289 (2020)

More data for this
Ligand-Target Pair