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SMILES: CC(C)COc1ncnc2[nH]cc(\C=C\C(O)=O)c12

InChI Key: InChIKey=OQDJNLKOMYTWEB-ONEGZZNKSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 254955   
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 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1


(Homo sapiens (Human))		BDBM254955
PNG
(US9505765, 178)
Show SMILES CC(C)COc1ncnc2[nH]cc(\C=C\C(O)=O)c12
Show InChI InChI=1S/C13H15N3O3/c1-8(2)6-19-13-11-9(3-4-10(17)18)5-14-12(11)15-7-16-13/h3-5,7-8H,6H2,1-2H3,(H,17,18)(H,14,15,16)/b4-3+
PDB

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US Patent
n/an/a 340n/an/an/an/an/an/a



CONFLUENCE LIFE SCIENCES INC.

US Patent


Assay Description
TAK1-TAB1 Binding Inhibitory Potency: The ability of candidate compounds to interact with TAK1-TAB1 is quantitated by a competitive binding assay usi...

US Patent US9505765 (2016)


BindingDB Entry DOI: 10.7270/Q2T43S1J
More data for this
Ligand-Target Pair