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BDBM130563 US8822447, 28

SMILES: CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC2CCCNC2)C1=O

InChI Key: InChIKey=IEUPVAAEHASTLE-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 130563   
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
Ketohexokinase


(Homo sapiens (Human))
BDBM130563
PNG
(US8822447, 28)
Show SMILES CSc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC2CCCNC2)C1=O
Show InChI InChI=1S/C23H27N5OS/c1-30-22-20-10-9-19(14-21(20)28(25-22)18-7-3-2-4-8-18)27-13-12-26(23(27)29)16-17-6-5-11-24-15-17/h2-4,7-10,14,17,24H,5-6,11-13,15-16H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

n/an/a 3.04E+3n/an/an/an/an/a25



Janssen Pharmaceutica NV

US Patent


Assay Description
An enzymatic assay was developed to measure KHK-mediated conversion of D-fructose to Fructose-1-P (F-1-P) using High Throughput Mass Spectroscopy (HT...


US Patent US8822447 (2014)


BindingDB Entry DOI: 10.7270/Q2M0443Q
More data for this
Ligand-Target Pair