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SMILES: Oc1ccc(\C=N\Nc2cn[nH]c(=O)c2Cl)cc1[N+]([O-])=O

InChI Key: InChIKey=WUVOGTSGMTVCGA-YIXHJXPBSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50509111   
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
DNA ligase 1


(Homo sapiens (Human))		BDBM50509111
PNG
(CHEMBL4468667)
Show SMILES Oc1ccc(\C=N\Nc2cn[nH]c(=O)c2Cl)cc1[N+]([O-])=O
Show InChI InChI=1S/C11H8ClN5O4/c12-10-7(5-14-16-11(10)19)15-13-4-6-1-2-9(18)8(3-6)17(20)21/h1-5,18H,(H2,15,16,19)/b13-4+
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n/an/a 1.20E+4n/an/an/an/an/an/a



University of Allahabad

Curated by ChEMBL


Assay Description
Uncompetitive inhibition of human DNA ligase 1 using nicked DNA as substrate by high-throughput fluorescence energy transfer-based DNA joining assay

Eur J Med Chem 182: (2019)


Article DOI: 10.1016/j.ejmech.2019.111657
More data for this
Ligand-Target Pair