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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50109802   
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
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM50109802
PNG
(2-Benzo[1,3]dioxol-5-yl-3-[2-(6,7-dimethoxy-3,4-di...)
Show SMILES COc1cc2CCN(CCn3c(nc4ccccc4c3=O)-c3ccc4OCOc4c3)Cc2cc1OC
Show InChI InChI=1S/C28H27N3O5/c1-33-24-13-18-9-10-30(16-20(18)15-25(24)34-2)11-12-31-27(19-7-8-23-26(14-19)36-17-35-23)29-22-6-4-3-5-21(22)28(31)32/h3-8,13-15H,9-12,16-17H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Xenova Ltd.

Curated by ChEMBL


Assay Description
Inhibition of multidrug resistance associated protein type 1 (MRP1) assayed by an accumulation assay in COR.L23/R cells


Bioorg Med Chem Lett 12: 571-4 (2002)


BindingDB Entry DOI: 10.7270/Q2PV6JP9
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Mus musculus)
BDBM50109802
PNG
(2-Benzo[1,3]dioxol-5-yl-3-[2-(6,7-dimethoxy-3,4-di...)
Show SMILES COc1cc2CCN(CCn3c(nc4ccccc4c3=O)-c3ccc4OCOc4c3)Cc2cc1OC
Show InChI InChI=1S/C28H27N3O5/c1-33-24-13-18-9-10-30(16-20(18)15-25(24)34-2)11-12-31-27(19-7-8-23-26(14-19)36-17-35-23)29-22-6-4-3-5-21(22)28(31)32/h3-8,13-15H,9-12,16-17H2,1-2H3
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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 3.70E+3n/an/an/an/an/an/a



Xenova Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against P-glyco-protein (Pgp) using accumulation assay for Pgp expressing EMT6/AR1.0 cells.


Bioorg Med Chem Lett 12: 571-4 (2002)


BindingDB Entry DOI: 10.7270/Q2PV6JP9
More data for this
Ligand-Target Pair