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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kinesin-like protein 1' and Ligand = 'BDBM50068388'   
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
Kinesin-like protein 1


(Homo sapiens (Human))
BDBM50068388
PNG
(CHEMBL3402349)
Show SMILES NCCC(=O)N1N=C(SC11CCOc2ccccc12)c1cc(F)ccc1F |c:6|
Show InChI InChI=1/C19H17F2N3O2S/c20-12-5-6-15(21)13(11-12)18-23-24(17(25)7-9-22)19(27-18)8-10-26-16-4-2-1-3-14(16)19/h1-6,11H,7-10,22H2
PDB
MMDB

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Article
PubMed
n/an/an/an/a>500n/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