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BDBM187064 US9169209, Table 3, Compound 97

SMILES: Cc1cc(ccc1F)S(=O)(=O)c1ccc(NC(=O)\C=C\c2cccnc2)cc1

InChI Key: InChIKey=YKNPIQLETBLLNK-NYYWCZLTSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 187064   
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
Nicotinamide phosphoribosyltransferase


(Homo sapiens (Human))
BDBM187064
PNG
(US9169209, Table 3, Compound 97)
Show SMILES Cc1cc(ccc1F)S(=O)(=O)c1ccc(NC(=O)\C=C\c2cccnc2)cc1
Show InChI InChI=1S/C21H17FN2O3S/c1-15-13-19(9-10-20(15)22)28(26,27)18-7-5-17(6-8-18)24-21(25)11-4-16-3-2-12-23-14-16/h2-14H,1H3,(H,24,25)/b11-4+
PDB
MMDB

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Similars

US Patent
n/an/a 21.9n/an/an/an/a7.525



FORMA TM, LLC

US Patent


Assay Description
The NAMPT enzymatic reactions were carried out in Buffer A (50 mM Hepes pH 7.5, 50 mM NaCl, 5 mM MgCl2, and 1 mM THP) in 96-well V-bottom plates. The...


US Patent US9169209 (2015)


BindingDB Entry DOI: 10.7270/Q28G8JH9
More data for this
Ligand-Target Pair