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Compile Data Set for Download or QSAR

Found 27 hits with Last Name = 'adamo' and Initial = 'c'   
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
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202570
PNG
(4-bromo-2-methoxy-N-(2,4,5-trimethoxyphenyl)benzam...)
Show SMILES COc1cc(OC)c(OC)cc1NC(=O)c1ccc(Br)cc1OC
Show InChI InChI=1S/C17H18BrNO5/c1-21-13-7-10(18)5-6-11(13)17(20)19-12-8-15(23-3)16(24-4)9-14(12)22-2/h5-9H,1-4H3,(H,19,20)
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n/an/a 1.54E+3n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202567
PNG
(2,4,5-Trimethoxy-N-(2-methoxy-phenyl)-benzamide (1...)
Show SMILES COc1ccccc1NC(=O)c1cc(OC)c(OC)cc1OC
Show InChI InChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)18-17(19)11-9-15(22-3)16(23-4)10-14(11)21-2/h5-10H,1-4H3,(H,18,19)
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n/an/a 3.52E+3n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM81939
PNG
(CAS_52-53-9 | NSC_62969 | VERAPAMIL)
Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC
Show InChI InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3
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n/an/a 3.53E+3n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202563
PNG
(N-(4-Bromo-phenyl)-2,4,5-trimethoxy-benzamide (10))
Show SMILES COc1cc(OC)c(cc1OC)C(=O)Nc1ccc(Br)cc1
Show InChI InChI=1S/C16H16BrNO4/c1-20-13-9-15(22-3)14(21-2)8-12(13)16(19)18-11-6-4-10(17)5-7-11/h4-9H,1-3H3,(H,18,19)
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n/an/a 9.27E+3n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202564
PNG
(N-(4-Bromo-phenyl)-2,3,4-trimethoxy-benzamide (11))
Show SMILES COc1ccc(C(=O)Nc2ccc(Br)cc2)c(OC)c1OC
Show InChI InChI=1S/C16H16BrNO4/c1-20-13-9-8-12(14(21-2)15(13)22-3)16(19)18-11-6-4-10(17)5-7-11/h4-9H,1-3H3,(H,18,19)
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n/an/a 1.94E+4n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202560
PNG
(2,4,5-Trimethoxy-N-phenyl-benzamide (6))
Show SMILES COc1cc(OC)c(cc1OC)C(=O)Nc1ccccc1
Show InChI InChI=1S/C16H17NO4/c1-19-13-10-15(21-3)14(20-2)9-12(13)16(18)17-11-7-5-4-6-8-11/h4-10H,1-3H3,(H,17,18)
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n/an/a 2.19E+4n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202566
PNG
(3,4,5-Trimethoxy-N-(2-methoxy-phenyl)-benzamide (1...)
Show SMILES COc1ccccc1NC(=O)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)18-17(19)11-9-14(21-2)16(23-4)15(10-11)22-3/h5-10H,1-4H3,(H,18,19)
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n/an/a 2.62E+4n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM50363079
PNG
(CHEMBL1944863 | N-(4-bromophenyl)-3,4,5-trimethoxy...)
Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1ccc(Br)cc1
Show InChI InChI=1S/C16H16BrNO4/c1-20-13-8-10(9-14(21-2)15(13)22-3)16(19)18-12-6-4-11(17)5-7-12/h4-9H,1-3H3,(H,18,19)
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n/an/a 2.70E+4n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202568
PNG
(2,3,4-Trimethoxy-N-(2-methoxy-phenyl)-benzamide (1...)
Show SMILES COc1ccccc1NC(=O)c1ccc(OC)c(OC)c1OC
Show InChI InChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)18-17(19)11-9-10-14(21-2)16(23-4)15(11)22-3/h5-10H,1-4H3,(H,18,19)
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Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202569
PNG
(2,4,6-Trimethoxy-N-(2-methoxy-phenyl)-benzamide (1...)
Show SMILES COc1cc(OC)c(C(=O)Nc2ccccc2OC)c(OC)c1
Show InChI InChI=1S/C17H19NO5/c1-20-11-9-14(22-3)16(15(10-11)23-4)17(19)18-12-7-5-6-8-13(12)21-2/h5-10H,1-4H3,(H,18,19)
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n/an/a 4.76E+4n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202559
PNG
(3,4,5-trimethoxy-N-phenylbenzamide (5))
Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1ccccc1
Show InChI InChI=1S/C16H17NO4/c1-19-13-9-11(10-14(20-2)15(13)21-3)16(18)17-12-7-5-4-6-8-12/h4-10H,1-3H3,(H,17,18)
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n/an/a 7.07E+4n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202568
PNG
(2,3,4-Trimethoxy-N-(2-methoxy-phenyl)-benzamide (1...)
Show SMILES COc1ccccc1NC(=O)c1ccc(OC)c(OC)c1OC
Show InChI InChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)18-17(19)11-9-10-14(21-2)16(23-4)15(11)22-3/h5-10H,1-4H3,(H,18,19)
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n/an/a 7.10E+4n/an/an/an/an/an/a



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Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202565
PNG
(N-(4-Bromo-phenyl)-2,4,6-trimethoxy-benzamide (12))
Show SMILES COc1cc(OC)c(C(=O)Nc2ccc(Br)cc2)c(OC)c1
Show InChI InChI=1S/C16H16BrNO4/c1-20-12-8-13(21-2)15(14(9-12)22-3)16(19)18-11-6-4-10(17)5-7-11/h4-9H,1-3H3,(H,18,19)
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Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202570
PNG
(4-bromo-2-methoxy-N-(2,4,5-trimethoxyphenyl)benzam...)
Show SMILES COc1cc(OC)c(OC)cc1NC(=O)c1ccc(Br)cc1OC
Show InChI InChI=1S/C17H18BrNO5/c1-21-13-7-10(18)5-6-11(13)17(20)19-12-8-15(23-3)16(24-4)9-14(12)22-2/h5-9H,1-4H3,(H,19,20)
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UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202569
PNG
(2,4,6-Trimethoxy-N-(2-methoxy-phenyl)-benzamide (1...)
Show SMILES COc1cc(OC)c(C(=O)Nc2ccccc2OC)c(OC)c1
Show InChI InChI=1S/C17H19NO5/c1-20-11-9-14(22-3)16(15(10-11)23-4)17(19)18-12-7-5-6-8-13(12)21-2/h5-10H,1-4H3,(H,18,19)
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UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202567
PNG
(2,4,5-Trimethoxy-N-(2-methoxy-phenyl)-benzamide (1...)
Show SMILES COc1ccccc1NC(=O)c1cc(OC)c(OC)cc1OC
Show InChI InChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)18-17(19)11-9-15(22-3)16(23-4)10-14(11)21-2/h5-10H,1-4H3,(H,18,19)
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UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202566
PNG
(3,4,5-Trimethoxy-N-(2-methoxy-phenyl)-benzamide (1...)
Show SMILES COc1ccccc1NC(=O)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)18-17(19)11-9-14(21-2)16(23-4)15(10-11)22-3/h5-10H,1-4H3,(H,18,19)
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UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202565
PNG
(N-(4-Bromo-phenyl)-2,4,6-trimethoxy-benzamide (12))
Show SMILES COc1cc(OC)c(C(=O)Nc2ccc(Br)cc2)c(OC)c1
Show InChI InChI=1S/C16H16BrNO4/c1-20-12-8-13(21-2)15(14(9-12)22-3)16(19)18-11-6-4-10(17)5-7-11/h4-9H,1-3H3,(H,18,19)
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Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202564
PNG
(N-(4-Bromo-phenyl)-2,3,4-trimethoxy-benzamide (11))
Show SMILES COc1ccc(C(=O)Nc2ccc(Br)cc2)c(OC)c1OC
Show InChI InChI=1S/C16H16BrNO4/c1-20-13-9-8-12(14(21-2)15(13)22-3)16(19)18-11-6-4-10(17)5-7-11/h4-9H,1-3H3,(H,18,19)
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Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202563
PNG
(N-(4-Bromo-phenyl)-2,4,5-trimethoxy-benzamide (10))
Show SMILES COc1cc(OC)c(cc1OC)C(=O)Nc1ccc(Br)cc1
Show InChI InChI=1S/C16H16BrNO4/c1-20-13-9-15(22-3)14(21-2)8-12(13)16(19)18-11-6-4-10(17)5-7-11/h4-9H,1-3H3,(H,18,19)
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Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM50363079
PNG
(CHEMBL1944863 | N-(4-bromophenyl)-3,4,5-trimethoxy...)
Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1ccc(Br)cc1
Show InChI InChI=1S/C16H16BrNO4/c1-20-13-8-10(9-14(21-2)15(13)22-3)16(19)18-12-6-4-11(17)5-7-12/h4-9H,1-3H3,(H,18,19)
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UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202562
PNG
(2,4,6-Trimethoxy-N-phenyl-benzamide (8))
Show SMILES COc1cc(OC)c(C(=O)Nc2ccccc2)c(OC)c1
Show InChI InChI=1S/C16H17NO4/c1-19-12-9-13(20-2)15(14(10-12)21-3)16(18)17-11-7-5-4-6-8-11/h4-10H,1-3H3,(H,17,18)
PDB

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n/an/a>1.00E+5n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202561
PNG
(2,3,4-Trimethoxy-N-phenyl-benzamide (7))
Show SMILES COc1ccc(C(=O)Nc2ccccc2)c(OC)c1OC
Show InChI InChI=1S/C16H17NO4/c1-19-13-10-9-12(14(20-2)15(13)21-3)16(18)17-11-7-5-4-6-8-11/h4-10H,1-3H3,(H,17,18)
PDB

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n/an/a>1.00E+5n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202560
PNG
(2,4,5-Trimethoxy-N-phenyl-benzamide (6))
Show SMILES COc1cc(OC)c(cc1OC)C(=O)Nc1ccccc1
Show InChI InChI=1S/C16H17NO4/c1-19-13-10-15(21-3)14(20-2)9-12(13)16(18)17-11-7-5-4-6-8-11/h4-10H,1-3H3,(H,17,18)
PDB

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UniChem
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n/an/a>1.00E+5n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202562
PNG
(2,4,6-Trimethoxy-N-phenyl-benzamide (8))
Show SMILES COc1cc(OC)c(C(=O)Nc2ccccc2)c(OC)c1
Show InChI InChI=1S/C16H17NO4/c1-19-12-9-13(20-2)15(14(10-12)21-3)16(18)17-11-7-5-4-6-8-11/h4-10H,1-3H3,(H,17,18)
PDB

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UniChem
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UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
P-glycoprotein 1


(Homo sapiens (Human))
BDBM202561
PNG
(2,3,4-Trimethoxy-N-phenyl-benzamide (7))
Show SMILES COc1ccc(C(=O)Nc2ccccc2)c(OC)c1OC
Show InChI InChI=1S/C16H17NO4/c1-19-13-10-9-12(14(20-2)15(13)21-3)16(18)17-11-7-5-4-6-8-11/h4-10H,1-3H3,(H,17,18)
PDB

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UniChem
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n/an/a>1.00E+5n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM202559
PNG
(3,4,5-trimethoxy-N-phenylbenzamide (5))
Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1ccccc1
Show InChI InChI=1S/C16H17NO4/c1-19-13-9-11(10-14(20-2)15(13)21-3)16(18)17-12-7-5-4-6-8-12/h4-10H,1-3H3,(H,17,18)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
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n/an/a>1.00E+5n/an/an/an/an/an/a



UniversitÓ di Bari Aldo Moro



Assay Description
MDCK-MDR1 or MDCK-MRP1 cells (50,000 cells per well) were seeded into black CulturePlate (96-well plate) with 100 μL medium and allowed to becom...


Chem Biol Drug Des 88: 820-831 (2016)


Article DOI: 10.1111/cbdd.12811
BindingDB Entry DOI: 10.7270/Q2NC600K
More data for this
Ligand-Target Pair