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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50428356   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
ATP-binding cassette sub-family G member 2


(Homo sapiens (Human))
BDBM50428356
PNG
(CHEMBL2331722)
Show SMILES COCCOCCOCCOc1cc2CCN(Cc3ccc(cc3)-c3ccc(C(=O)OC)c(NC(=O)c4ccc5ccccc5n4)c3)Cc2cc1OCCOCCOCCOC
Show InChI InChI=1S/C48H57N3O11/c1-54-18-20-57-22-24-59-26-28-61-45-31-39-16-17-51(34-40(39)32-46(45)62-29-27-60-25-23-58-21-19-55-2)33-35-8-10-36(11-9-35)38-12-14-41(48(53)56-3)44(30-38)50-47(52)43-15-13-37-6-4-5-7-42(37)49-43/h4-15,30-32H,16-29,33-34H2,1-3H3,(H,50,52)
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 839n/an/an/an/an/an/a



University of Regensburg

Curated by ChEMBL


Assay Description
Inhibition of ABCG2 in human MCF7/Topo cells after 2 hrs by Hoechst 33342 microplate assay


ACS Med Chem Lett 4: 393-6 (2013)


Article DOI: 10.1021/ml4000832
BindingDB Entry DOI: 10.7270/Q2T72JRQ
More data for this
Ligand-Target Pair