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BDBM50068358 CHEMBL3402342

SMILES: CC(=O)N1N=C(SC11CCN(C(C)=O)c2ccccc12)c1cc(F)ccc1F

InChI Key: InChIKey=KLSJYXRHPFHDGE-UHFFFAOYNA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50068358   
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)
BDBM50068358
PNG
(CHEMBL3402342)
Show SMILES CC(=O)N1N=C(SC11CCN(C(C)=O)c2ccccc12)c1cc(F)ccc1F
Show InChI InChI=1/C20H17F2N3O2S/c1-12(26)24-10-9-20(16-5-3-4-6-18(16)24)25(13(2)27)23-19(28-20)15-11-14(21)7-8-17(15)22/h3-8,11H,9-10H2,1-2H3
PDB
MMDB

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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