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BDBM50378135 CHEMBL4165434

SMILES: Cc1oc2c(c1C(=O)OCC(O)CO)C(=O)c1ncccc1C2=O

InChI Key: InChIKey=VYDOWTGEDPJUAU-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50378135   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50378135
PNG
(CHEMBL4165434)
Show SMILES Cc1oc2c(c1C(=O)OCC(O)CO)C(=O)c1ncccc1C2=O
Show InChI InChI=1S/C16H13NO7/c1-7-10(16(22)23-6-8(19)5-18)11-14(21)12-9(3-2-4-17-12)13(20)15(11)24-7/h2-4,8,18-19H,5-6H2,1H3
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+4n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of human TDP2 expressed in TDP2 deficient chicken DT40 whole cell extracts using TY19 DNA as substrate after 15 mins by by PAGE analysis


Eur J Med Chem 151: 777-796 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.024
BindingDB Entry DOI: 10.7270/Q20R9RZ8
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50378135
PNG
(CHEMBL4165434)
Show SMILES Cc1oc2c(c1C(=O)OCC(O)CO)C(=O)c1ncccc1C2=O
Show InChI InChI=1S/C16H13NO7/c1-7-10(16(22)23-6-8(19)5-18)11-14(21)12-9(3-2-4-17-12)13(20)15(11)24-7/h2-4,8,18-19H,5-6H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human TDP2 using TY18 (alpha-[32P]-cordycepin-3'-labeled) as substrate after 15 mins by PAGE analysis


Eur J Med Chem 151: 777-796 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.024
BindingDB Entry DOI: 10.7270/Q20R9RZ8
More data for this
Ligand-Target Pair