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SMILES: OC(=O)[C@H]1C2CCC(CC2)[C@@H]1n1cc(C#N)c2cnc(nc12)-c1c[nH]c2ncc(F)cc12

InChI Key: InChIKey=IEMDOPPDKYNLJS-UHBICSCXSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50507224   
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
Polymerase basic protein 2


(Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)		BDBM50507224
PNG
(CHEMBL4580408)
Show SMILES OC(=O)[C@H]1C2CCC(CC2)[C@@H]1n1cc(C#N)c2cnc(nc12)-c1c[nH]c2ncc(F)cc12 |r,wU:3.2,wD:10.12,(29.83,-2.09,;31.16,-2.85,;32.49,-2.07,;31.17,-4.39,;32.52,-5.15,;32.53,-6.69,;31.2,-7.47,;29.87,-6.71,;30.63,-5.42,;31.74,-6.33,;29.86,-5.17,;28.55,-4.41,;27.51,-3.27,;26.11,-3.91,;24.79,-3.15,;23.47,-2.4,;26.28,-5.44,;25.26,-6.59,;25.74,-8.05,;27.24,-8.37,;28.27,-7.21,;27.79,-5.75,;27.72,-9.82,;26.82,-11.07,;27.73,-12.31,;29.19,-11.83,;30.53,-12.6,;31.86,-11.83,;31.86,-10.28,;33.19,-9.5,;30.53,-9.51,;29.19,-10.29,)|
Show InChI InChI=1S/C23H19FN6O2/c24-14-5-15-17(9-27-20(15)26-7-14)21-28-8-16-13(6-25)10-30(22(16)29-21)19-12-3-1-11(2-4-12)18(19)23(31)32/h5,7-12,18-19H,1-4H2,(H,26,27)(H,31,32)/t11?,12?,18-,19-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 70n/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of PB2 in Influenza A virus (A/Weiss/1943(H1N1)) infected in MDCK cells assessed as reduction in virus induced cell death after 5 days by ...

Eur J Med Chem 162: 249-265 (2019)


Article DOI: 10.1016/j.ejmech.2018.11.015
More data for this
Ligand-Target Pair