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BDBM180102 US9676721, 99 2-cyano-3-(pyridin-4-yl)-1-{[4-(quinoline-8-sulfonyl)phenyl]methyl}guanidine

SMILES: O=S(=O)(c1ccc(CN\C(Nc2ccncc2)=N/C#N)cc1)c1cccc2cccnc12

InChI Key: InChIKey=FFUYSUUDPLJAKW-UHFFFAOYSA-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 = 180102   
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 (NAMPT)


(Homo sapiens (Human))
BDBM180102
PNG
(US9676721, 99 2-cyano-3-(pyridin-4-yl)-1-{[4-(quin...)
Show SMILES O=S(=O)(c1ccc(CN\C(Nc2ccncc2)=N/C#N)cc1)c1cccc2cccnc12
Show InChI InChI=1S/C23H18N6O2S/c24-16-28-23(29-19-10-13-25-14-11-19)27-15-17-6-8-20(9-7-17)32(30,31)21-5-1-3-18-4-2-12-26-22(18)21/h1-14H,15H2,(H2,25,27,28,29)
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 2.90n/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 US9676721 (2017)


BindingDB Entry DOI: 10.7270/Q2VD6WMM
More data for this
Ligand-Target Pair