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BDBM50172525 2-(5-Hydroxy-pent-1-ynyl)-7-methyl-4-oxo-4,7-dihydro-thieno[2,3-b]pyridine-5-carboxylic acid 4-chloro-benzylamide::CHEMBL194706

SMILES: Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(sc12)C#CCCCO

InChI Key: InChIKey=STYYWMBJOLNBNF-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50172525   
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 polymerase


(Human cytomegalovirus (HCMV strain AD169) )
BDBM50172525
PNG
(2-(5-Hydroxy-pent-1-ynyl)-7-methyl-4-oxo-4,7-dihyd...)
Show SMILES Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(sc12)C#CCCCO
Show InChI InChI=1S/C21H19ClN2O3S/c1-24-13-18(20(27)23-12-14-6-8-15(22)9-7-14)19(26)17-11-16(28-21(17)24)5-3-2-4-10-25/h6-9,11,13,25H,2,4,10,12H2,1H3,(H,23,27)
UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.20E+4n/an/an/an/a7.5n/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Inhibition of human cytomegalovirus DNA polymerase (95 uL) activity in a solution containing 6.4 mM HEPES (pH 7.5), incubation for 12 minutes at 26 d...


J Med Chem 48: 5794-804 (2005)


Article DOI: 10.1021/jm050162b
BindingDB Entry DOI: 10.7270/Q2G44R39
More data for this
Ligand-Target Pair