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SMILES: [#6]-[#8]-c1cc(ccc1-[#8])-[#6]-1-[#8]-c2cc(ccc2-[#8]-[#6]-1-[#6]-[#8])-c1oc2c(-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])cc(-[#8])c2c(=O)c1-[#8]

InChI Key: InChIKey=MLWNTYYGBNTWKM-UFWORHAWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50084981   
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
ATP-dependent translocase ABCB1


(Mus musculus (Mouse))		BDBM50084981
PNG
(8-((E)-3,7-Dimethyl-octa-2,6-dienyl)-3,5,7-trihydr...)
Show SMILES [#6]-[#8]-c1cc(ccc1-[#8])-[#6]-1-[#8]-c2cc(ccc2-[#8]-[#6]-1-[#6]-[#8])-c1oc2c(-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])cc(-[#8])c2c(=O)c1-[#8]
Show InChI InChI=1S/C35H36O10/c1-18(2)6-5-7-19(3)8-11-22-24(38)16-25(39)30-31(40)32(41)34(45-35(22)30)21-10-13-26-28(15-21)44-33(29(17-36)43-26)20-9-12-23(37)27(14-20)42-4/h6,8-10,12-16,29,33,36-39,41H,5,7,11,17H2,1-4H3/b19-8+
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/a 120n/an/an/an/an/a



Universit£ Claude Bernard-Lyon 1

Curated by ChEMBL


Assay Description
Compound was tested for the binding affinity towards recombinant NBD2 C-terminal cytotoxic nucleotide-binding domain of mouse P-Glycoprotein

Bioorg Med Chem Lett 10: 157-60 (2000)


BindingDB Entry DOI: 10.7270/Q2DR2W1W
More data for this
Ligand-Target Pair