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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 389579   
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
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM389579
PNG
(N,N-dimethyl-N'-(2-{(E)-2-[4- (methylthio)phenyl]v...)
Show SMILES CSc1ccc(\C=C\c2nc(NCCCN(C)C)c3ccccc3n2)cc1
Show InChI InChI=1S/C22H26N4S/c1-26(2)16-6-15-23-22-19-7-4-5-8-20(19)24-21(25-22)14-11-17-9-12-18(27-3)13-10-17/h4-5,7-14H,6,15-16H2,1-3H3,(H,23,24,25)/b14-11+
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.07E+3n/an/an/an/an/an/a



Vichem Chemie Research Ltd

Curated by ChEMBL


Assay Description
Inhibition of FLT3 ITD mutant (unknown origin) using TAMRA-Src-tide as substrate measured after 1 hr in presence of ATP at its Km concentration by IM...


Eur J Med Chem 184: (2019)


Article DOI: 10.1016/j.ejmech.2019.111710
BindingDB Entry DOI: 10.7270/Q27947ZV
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM389579
PNG
(N,N-dimethyl-N'-(2-{(E)-2-[4- (methylthio)phenyl]v...)
Show SMILES CSc1ccc(\C=C\c2nc(NCCCN(C)C)c3ccccc3n2)cc1
Show InChI InChI=1S/C22H26N4S/c1-26(2)16-6-15-23-22-19-7-4-5-8-20(19)24-21(25-22)14-11-17-9-12-18(27-3)13-10-17/h4-5,7-14H,6,15-16H2,1-3H3,(H,23,24,25)/b14-11+
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PC cid
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UniChem
US Patent
n/an/a 4.50E+3n/an/an/an/an/an/a



Georgia Institute of Technology



Assay Description
FLT3(ITD) biochemical assays were performed on two different assay system platforms, using TranscreenerŽ ADP Assay FP method (BellBrook Labs, Madison...


J Med Chem 52: 456-68 (2009)


BindingDB Entry DOI: 10.7270/Q2NG4T0S
More data for this
Ligand-Target Pair