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BDBM371293 N-(1-Cyanocyclopropyl)-1-[(3-methylisoxazol-5-yl)methyl]-3-[(2-methylthiazol-5-yl)methyl]-2,4-dioxo-quinazoline-6-sulfonamide::US10239843, Example 400

SMILES: Cc1cc(Cn2c3ccc(cc3c(=O)n(Cc3cnc(C)o3)c2=O)S(=O)(=O)NC2(CC2)C#N)on1

InChI Key: InChIKey=GNFCKXREFIYWRD-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 371293   
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
poly(ADP-ribose) glycohydrolase (PARG)


(Homo sapiens (Human))
BDBM371293
PNG
(N-(1-Cyanocyclopropyl)-1-[(3-methylisoxazol-5-yl)m...)
Show SMILES Cc1cc(Cn2c3ccc(cc3c(=O)n(Cc3cnc(C)o3)c2=O)S(=O)(=O)NC2(CC2)C#N)on1
Show InChI InChI=1S/C22H20N6O6S/c1-13-7-15(34-25-13)10-27-19-4-3-17(35(31,32)26-22(12-23)5-6-22)8-18(19)20(29)28(21(27)30)11-16-9-24-14(2)33-16/h3-4,7-9,26H,5-6,10-11H2,1-2H3
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 27n/an/an/an/an/an/a



Istituto Superiore di Sanita



Assay Description
PARG In vitro assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length PARG (Produced internally by ...


J Med Chem 51: 1058-62 (2008)


BindingDB Entry DOI: 10.7270/Q21R6SSM
More data for this
Ligand-Target Pair