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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50033801   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
DNA topoisomerase 1


(Homo sapiens (Human))		BDBM50033801
PNG
(4-Ethyl-4-hydroxy-9-iodo-3,13-dioxo-3,4,12,13-tetr...)
Show SMILES CCC1(O)C(=O)OCc2c1cc1-c3nc4ccc(I)cc4c(C(O)=O)c3Cn1c2=O
Show InChI InChI=1S/C21H15IN2O6/c1-2-21(29)13-6-15-17-11(7-24(15)18(25)12(13)8-30-20(21)28)16(19(26)27)10-5-9(22)3-4-14(10)23-17/h3-6,29H,2,7-8H2,1H3,(H,26,27)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 2.30E+3n/an/an/an/an/an/a



Glaxo Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against topoisomerase I obtained from calf thymus

J Med Chem 38: 906-11 (1995)


BindingDB Entry DOI: 10.7270/Q2XG9Q55
More data for this
Ligand-Target Pair