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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Polymerase acidic protein' and Ligand = 'BDBM474364'   
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
Polymerase acidic protein


()
BDBM474364
PNG
((S)-6-benzhydryl-3-(difluoromethyl)-11- hydroxy-5,...)
Show SMILES Oc1c2-c3ncc(C(F)F)n3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|
Show InChI InChI=1S/C24H19F2N3O2/c25-23(26)17-13-27-24-21-22(31)19(30)11-12-28(21)18(14-29(17)24)20(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,18,20,23,31H,14H2/t18-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 40n/an/an/an/an/an/a


TBA

Assay Description
Compounds were dissolved and serially diluted in 100% DMSO then 0.5 μl was transferred to 384-well plates. 50 nM truncated Influenza A/victoria/...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2Z60S8G
More data for this
Ligand-Target Pair
Polymerase acidic protein


()
BDBM474364
PNG
((S)-6-benzhydryl-3-(difluoromethyl)-11- hydroxy-5,...)
Show SMILES Oc1c2-c3ncc(C(F)F)n3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|
Show InChI InChI=1S/C24H19F2N3O2/c25-23(26)17-13-27-24-21-22(31)19(30)11-12-28(21)18(14-29(17)24)20(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,18,20,23,31H,14H2/t18-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 40n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Compounds were dissolved and serially diluted in 100% DMSO then 0.5 μl was transferred to 384-well plates. 50 nM truncated Influenza A/victoria/...


US Patent US10858366 (2020)


BindingDB Entry DOI: 10.7270/Q2KH0RDJ
More data for this
Ligand-Target Pair