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BDBM50068359 CHEMBL3402341

SMILES: CN1CCC2(SC(=NN2C(C)=O)c2cc(F)ccc2F)c2ccccc12

InChI Key: InChIKey=RPUYDKPZKMDJFX-UHFFFAOYNA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50068359   
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-like protein 1


(Homo sapiens)
BDBM50068359
PNG
(CHEMBL3402341)
Show SMILES CN1CCC2(SC(=NN2C(C)=O)c2cc(F)ccc2F)c2ccccc12
Show InChI InChI=1/C19H17F2N3OS/c1-12(25)24-19(9-10-23(2)17-6-4-3-5-15(17)19)26-18(22-24)14-11-13(20)7-8-16(14)21/h3-8,11H,9-10H2,1-2H3
PDB
MMDB

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PC sid
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Similars

Article
PubMed
n/an/an/an/a>1.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KSP in human HCT116 cells assessed as phos-histone H3 level by immunofluorescent assay


Bioorg Med Chem 23: 2424-34 (2015)

More data for this
Ligand-Target Pair