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BDBM24146 7,8-dichloro-4-(3-hydroxyphenyl)-N,N-dimethyl-1,2,3,4-tetrahydroisoquinoline-2-carboxamide::tetrahydroisoquinoline (THIQ), 50

SMILES: CN(C)C(=O)N1CC(c2cccc(O)c2)c2ccc(Cl)c(Cl)c2C1

InChI Key: InChIKey=UMODMSWPONWCHE-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 24146   
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
Kinesin Spindle Protein Eg5


(Homo sapiens (Human))
BDBM24146
PNG
(7,8-dichloro-4-(3-hydroxyphenyl)-N,N-dimethyl-1,2,...)
Show SMILES CN(C)C(=O)N1CC(c2cccc(O)c2)c2ccc(Cl)c(Cl)c2C1
Show InChI InChI=1S/C18H18Cl2N2O2/c1-21(2)18(24)22-9-14(11-4-3-5-12(23)8-11)13-6-7-16(19)17(20)15(13)10-22/h3-8,14,23H,9-10H2,1-2H3
PDB
MMDB

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Similars

Article
PubMed
n/an/a 1.27E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company



Assay Description
ATPase assays with Eg5 motor domain protein were performed using Kinase-Glo Luminescent Kit as described by the manufacturer (Promega).


Bioorg Med Chem Lett 16: 2095-100 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.056
BindingDB Entry DOI: 10.7270/Q2VM49KF
More data for this
Ligand-Target Pair