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SMILES: Nc1ncnc2n(nc(Sc3ccccn3)c12)[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)O1

InChI Key: InChIKey=JEBJQJWSEHVCEX-IQJOONFLSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 476139   
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
Ubiquitin-like modifier-activating enzyme ATG7


(Homo sapiens (Human))		BDBM476139
PNG
(US10865208, Compound I-194 | {(2R,3S,5R)-5-[4-amin...)
Show SMILES Nc1ncnc2n(nc(Sc3ccccn3)c12)[C@H]1C[C@H](O)[C@@H](COS(N)(=O)=O)O1 |r|
Show InChI InChI=1S/C15H17N7O5S2/c16-13-12-14(20-7-19-13)22(21-15(12)28-10-3-1-2-4-18-10)11-5-8(23)9(27-11)6-26-29(17,24)25/h1-4,7-9,11,23H,5-6H2,(H2,16,19,20)(H2,17,24,25)/t8-,9+,11+/m0/s1
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US Patent
n/an/a 35n/an/an/an/an/an/a



MILLENNIUM PHARMACEUTICALS, INC.

US Patent


Assay Description
The total volume of the ATG7 enzymatic assay is 50 μL and contains 50 mM HEPES Hemisodium (pH 7.5), 0.05% BSA, 0.01% Tween-20, 25 mM NaCl, 5 mM ...

US Patent US10865208 (2020)


BindingDB Entry DOI: 10.7270/Q23B6366
More data for this
Ligand-Target Pair