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SMILES: CC(C)(C)c1ccc2N[C@H]([C@@H]3CCCO[C@@H]3c2c1)c1ccc(O)c(O)c1

InChI Key: InChIKey=UCPLSQHMOLJMQH-JHVJFLLYSA-N

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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 = 50313408   
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 KIF11


(Homo sapiens (Human))		BDBM50313408
PNG
(4-((4aS,5R,10bS)-9-tert-butyl-3,4,4a,5,6,10b-hexah...)
Show SMILES CC(C)(C)c1ccc2N[C@H]([C@@H]3CCCO[C@@H]3c2c1)c1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C22H27NO3/c1-22(2,3)14-7-8-17-16(12-14)21-15(5-4-10-26-21)20(23-17)13-6-9-18(24)19(25)11-13/h6-9,11-12,15,20-21,23-25H,4-5,10H2,1-3H3/t15-,20-,21-/m0/s1
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Article
PubMed
n/an/a 95n/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