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BDBM50353782 CHEMBL1829409

SMILES: CCC(N(CCCN)C(=O)c1ccc(OC)cc1)c1nc2ccsc2c(=O)n1Cc1ccccc1

InChI Key: InChIKey=BGZZDTDZGABGIV-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50353782   
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))
BDBM50353782
PNG
(CHEMBL1829409)
Show SMILES CCC(N(CCCN)C(=O)c1ccc(OC)cc1)c1nc2ccsc2c(=O)n1Cc1ccccc1
Show InChI InChI=1/C27H30N4O3S/c1-3-23(30(16-7-15-28)26(32)20-10-12-21(34-2)13-11-20)25-29-22-14-17-35-24(22)27(33)31(25)18-19-8-5-4-6-9-19/h4-6,8-14,17,23H,3,7,15-16,18,28H2,1-2H3
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MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 210n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant C-terminal His6-tagged KSP ATPase activity after 1 hr by malachite green assay


J Med Chem 54: 6734-50 (2011)


Article DOI: 10.1021/jm200629m
BindingDB Entry DOI: 10.7270/Q2ZC838Z
More data for this
Ligand-Target Pair