BDBM50390978 VALSPODAR

SMILES C\C=C\C[C@@H](C)C(=O)[C@@H]1N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@@H](NC1=O)C(C)C)C(C)C

InChI Key InChIKey=YJDYDFNKCBANTM-QCWCSKBGSA-N

Data  4 KI  5 IC50  2 EC50

  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 11 hits for monomerid = 50390978   

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataKi:  134nMAssay Description:TP_TRANSPORTER: inhibition of ATPase activity (Verapamil) in P-gp-MRP-16-Protein A complexMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataKi:  1.30E+3nMAssay Description:TP_TRANSPORTER: inhibition of Calcein-AM efflux in CEM/VBL 100 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetMultidrug resistance-associated protein 1(Human)
Deutsches Krebsforschungszentrum

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataKi:  2.70E+4nMAssay Description:TP_TRANSPORTER: inhibition of LTC4 uptake in membrane vesicle from MRP1-expressing HeLa cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetATP-binding cassette sub-family C member 2(Human)
Kagoshima University

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataKi:  2.89E+4nMAssay Description:TP_TRANSPORTER: inhibition of LTC4 uptake in membrane vesicles from MRP2-expressing LLC PK1 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataIC50:  501nMAssay Description:Inhibition of P-glycoprotein-mediated daunorubicin efflux from human CCRF-CEM/VCR1000 cells after 240 secs by FACS flow cytometric analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataIC50:  22nMAssay Description:TP_TRANSPORTER: inhibition of Digoxin transepithelial transport (basal to apical) (Digoxin: 0.1 uM) in MDR1-expressing LLC-PK1 cellsMore data for this Ligand-Target Pair
In DepthDetails PubMed

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataIC50:  291nMAssay Description:TP_TRANSPORTER: inhibition of Doxorubicin transepithelial transport (basal to apical) (Doxorubicin: 0.8 uM) in MDR1-expressing LLC-PK1 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataEC50:  110nMAssay Description:TP_TRANSPORTER: increase in Calcein-AM intracellular accumulation (Calcein-AM: 0.25 uM) in MDR-P388 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataEC50:  410nMAssay Description:TP_TRANSPORTER: increase in Calcein-AM intracellular accumulation (Calcein-AM: 0.25 uM) in MDR-CEM cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataIC50:  110nMAssay Description:TP_TRANSPORTER: inhibition of Digoxin transepithelial transport (basal to apical) (Digoxin: 5 uM) in Caco-2 cellsMore data for this Ligand-Target Pair
In DepthDetails PubMed

TargetATP-dependent translocase ABCB1(Human)
Novartis Takarazuka Research Institute

Curated by ChEMBL
LigandPNGBDBM50390978(VALSPODAR)
Affinity DataIC50:  1.06E+3nMAssay Description:TP_TRANSPORTER: inhibition of Vinblastine transepithelial transport (basal to apical) (Vinblastine: 0.1 uM) in MDR1-expressing LLC-PK1 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed