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BDBM222901 US9315499, 3027

SMILES: CC1(C)CN(C1)C(=O)Cn1c2nccc(-c3cnc(N)nc3)c2cc(C(=O)NCc2ccc(Cl)cc2)c1=O

InChI Key: InChIKey=ZYDLEUBAHHGBDK-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 222901   
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 catalytic subunit


(Human cytomegalovirus (HCMV strain AD169) )
BDBM222901
PNG
(US9315499, 3027)
Show SMILES CC1(C)CN(C1)C(=O)Cn1c2nccc(-c3cnc(N)nc3)c2cc(C(=O)NCc2ccc(Cl)cc2)c1=O
Show InChI InChI=1S/C27H26ClN7O3/c1-27(2)14-34(15-27)22(36)13-35-23-20(19(7-8-30-23)17-11-32-26(29)33-12-17)9-21(25(35)38)24(37)31-10-16-3-5-18(28)6-4-16/h3-9,11-12H,10,13-15H2,1-2H3,(H,31,37)(H2,29,32,33)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 71n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The assay conditions are the following: 10 mM HEPES pH 7.5, 25 mM KCl, 7.5 mM NaCl, 5 mM MgCl2, 0.2 mg BSA/mL, 1 mM TCEP, 1.5% glycerol, 5% DMSO, 235...


US Patent US9315499 (2016)


BindingDB Entry DOI: 10.7270/Q2028QCZ
More data for this
Ligand-Target Pair