BDBM50140853 (4-{4-[2-(3,4-Difluoro-phenyl)-ethyl]-piperazin-1-yl}-5-methyl-5H-pyrido[3',4':4,5]pyrrolo[3,2-d]pyrimidin-9-yl)-methyl-amine::CHEMBL25731

SMILES CNc1nccc2n(C)c3c(ncnc3c12)N1CCN(CCc2ccc(F)c(F)c2)CC1

InChI Key InChIKey=AGHKIFOPIORNFQ-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50140853   

TargetMultidrug resistance-associated protein 1(Homo sapiens (Human))
Xenova

Curated by ChEMBL
LigandPNGBDBM50140853((4-{4-[2-(3,4-Difluoro-phenyl)-ethyl]-piperazin-1-...)
Affinity DataIC50:  28nMAssay Description:Inhibitory activity against MRP1 (Multidrug resistance associated protein 1) expressed in COR.L23/R cell line in single-dose potentiation assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMultidrug resistance-associated protein 1(Homo sapiens (Human))
Xenova

Curated by ChEMBL
LigandPNGBDBM50140853((4-{4-[2-(3,4-Difluoro-phenyl)-ethyl]-piperazin-1-...)
Affinity DataIC50:  115nMAssay Description:In vitro inhibitory activity against MRP1 (Multidrug resistance associated protein 1) expressed in COR.L23/R cell line in accumulation assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetATP-dependent translocase ABCB1(Mus musculus (Mouse))
Xenova

Curated by ChEMBL
LigandPNGBDBM50140853((4-{4-[2-(3,4-Difluoro-phenyl)-ethyl]-piperazin-1-...)
Affinity DataIC50:  1.90E+3nMAssay Description:Inhibitory activity against P-glycoprotein expressed in murine mammary carcinoma (EMT6/AR1.0 cell line) in single-dose potentiation assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Xenova

Curated by ChEMBL
LigandPNGBDBM50140853((4-{4-[2-(3,4-Difluoro-phenyl)-ethyl]-piperazin-1-...)
Affinity DataIC50:  5.38E+4nMAssay Description:Inhibitory activity against cytochrome P450 3A4More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMultidrug resistance-associated protein 1(Homo sapiens (Human))
Xenova

Curated by ChEMBL
LigandPNGBDBM50140853((4-{4-[2-(3,4-Difluoro-phenyl)-ethyl]-piperazin-1-...)
Affinity DataIC50: <250nMAssay Description:Inhibitory concentration against multidrug resistance associated protein 1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed