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BDBM50068389 CHEMBL3402350

SMILES: NCCCC(=O)N1N=C(SC11CCOc2ccccc12)c1cc(F)ccc1F

InChI Key: InChIKey=SXZGRKDCSDLPKD-UHFFFAOYNA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50068389   
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 (Human))
BDBM50068389
PNG
(CHEMBL3402350)
Show SMILES NCCCC(=O)N1N=C(SC11CCOc2ccccc12)c1cc(F)ccc1F |c:7|
Show InChI InChI=1/C20H19F2N3O2S/c21-13-7-8-16(22)14(12-13)19-24-25(18(26)6-3-10-23)20(28-19)9-11-27-17-5-2-1-4-15(17)20/h1-2,4-5,7-8,12H,3,6,9-11,23H2
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MMDB

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n/an/an/an/a 338n/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)


Article DOI: 10.1016/j.bmc.2015.03.052
More data for this
Ligand-Target Pair