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BDBM50313403 (4aS,5R,10bS)-8,9-dimethyl-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline::CHEMBL1078573

SMILES: Cc1cc2N[C@H]([C@@H]3CCCO[C@@H]3c2cc1C)c1ccccc1

InChI Key: InChIKey=VTPKJNUESARTJM-VDGAXYAQSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50313403   
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))
BDBM50313403
PNG
((4aS,5R,10bS)-8,9-dimethyl-5-phenyl-3,4,4a,5,6,10b...)
Show SMILES Cc1cc2N[C@H]([C@@H]3CCCO[C@@H]3c2cc1C)c1ccccc1 |r|
Show InChI InChI=1S/C20H23NO/c1-13-11-17-18(12-14(13)2)21-19(15-7-4-3-5-8-15)16-9-6-10-22-20(16)17/h3-5,7-8,11-12,16,19-21H,6,9-10H2,1-2H3/t16-,19-,20-/m0/s1
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MMDB

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Similars

Article
PubMed
n/an/a 1.25E+3n/an/an/an/an/an/a



Merck Serono

Curated by ChEMBL


Assay Description
Inhibition of ATPase activity of human recombinant EG5 assessed as ATP hydrolysis by pyruvate kinase-lactate dehydrogenase coupled assay


Bioorg Med Chem Lett 20: 1491-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.110
BindingDB Entry DOI: 10.7270/Q2KD1ZWN
More data for this
Ligand-Target Pair