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Compile Data Set for Download or QSAR

Found 9 hits of Enz. Inhib. data with enzyme = 'E3 ubiquitin-protein ligase Mdm2' and Substrate = 'biotinylated p53-derived peptide'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31274
PNG
(Chalcone derivative, B)
Show SMILES OC(=O)COc1ccc(\C=C\C(=O)c2ccc(Cl)c(Cl)c2)cc1
Show InChI InChI=1S/C17H12Cl2O4/c18-14-7-4-12(9-15(14)19)16(20)8-3-11-1-5-13(6-2-11)23-10-17(21)22/h1-9H,10H2,(H,21,22)/b8-3+
PDB
MMDB

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Article
PubMed
n/an/a 4.90E+4n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31275
PNG
(Chalcone derivative, B-1)
Show SMILES OC(=O)COc1ccc(cc1)C(=O)\C=C\c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H12Cl2O4/c18-14-7-1-11(9-15(14)19)2-8-16(20)12-3-5-13(6-4-12)23-10-17(21)22/h1-9H,10H2,(H,21,22)/b8-2+
PDB
MMDB

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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.17E+5n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31273
PNG
(Chalcone derivative, A)
Show SMILES OC(=O)COc1ccc(\C=C\C(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C17H13ClO4/c18-14-6-4-13(5-7-14)16(19)10-3-12-1-8-15(9-2-12)22-11-17(20)21/h1-10H,11H2,(H,20,21)/b10-3+
PDB
MMDB

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UniChem

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Article
PubMed
n/an/a 2.06E+5n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31279
PNG
(Chalcone derivative, F)
Show SMILES O=C(CC(=Nc1ccccc1)c1ccccc1)Nc1ccccc1
Show InChI InChI=1S/C21H18N2O/c24-21(23-19-14-8-3-9-15-19)16-20(17-10-4-1-5-11-17)22-18-12-6-2-7-13-18/h1-15H,16H2,(H,23,24)
PDB
MMDB

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Article
PubMed
n/an/a>2.50E+5n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31280
PNG
(Chalcone derivative, G)
Show SMILES CCOc1ccc(NC(=O)CC(=Nc2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C23H22N2O2/c1-2-27-21-15-13-20(14-16-21)25-23(26)17-22(18-9-5-3-6-10-18)24-19-11-7-4-8-12-19/h3-16H,2,17H2,1H3,(H,25,26)
PDB
MMDB

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Article
PubMed
n/an/a>2.50E+5n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31278
PNG
(Chalcone derivative, E)
Show SMILES CCOC(=O)C(C)(C)Oc1ccc(CCNC(=O)\C=C\C(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C24H26ClNO5/c1-4-30-23(29)24(2,3)31-20-11-5-17(6-12-20)15-16-26-22(28)14-13-21(27)18-7-9-19(25)10-8-18/h5-14H,4,15-16H2,1-3H3,(H,26,28)/b14-13+
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.50E+5n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31281
PNG
(Chalcone derivative, H)
Show SMILES O=C(C(C=Nc1ccccc1)c1ccccc1)C(=S)Nc1ccccc1
Show InChI InChI=1S/C22H18N2OS/c25-21(22(26)24-19-14-8-3-9-15-19)20(17-10-4-1-5-11-17)16-23-18-12-6-2-7-13-18/h1-16,20H,(H,24,26)
PDB
MMDB

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UniChem
Article
PubMed
n/an/a>2.50E+5n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31276
PNG
(Chalcone derivative, C)
Show SMILES CC(C)(Oc1ccc(\C=C\C(=O)c2ccc(Cl)cc2)cc1)C(O)=O
Show InChI InChI=1S/C19H17ClO4/c1-19(2,18(22)23)24-16-10-3-13(4-11-16)5-12-17(21)14-6-8-15(20)9-7-14/h3-12H,1-2H3,(H,22,23)/b12-5+
PDB
MMDB

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Article
PubMed
n/an/a 2.50E+5n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (human))
BDBM31277
PNG
(Chalcone derivative, D)
Show SMILES Oc1ccc2ccc3OCN(Cc4ccccc4)Cc3c2c1
Show InChI InChI=1S/C19H17NO2/c21-16-8-6-15-7-9-19-18(17(15)10-16)12-20(13-22-19)11-14-4-2-1-3-5-14/h1-10,21H,11-13H2
PDB
MMDB

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UniChem
Article
PubMed
n/an/a>2.50E+5n/an/an/an/a7.423



Max Planck Institute



Assay Description
Interference of the p53-MDM2 binding by test compounds was measured in a 96-well polypropylene round-bottom microtiter plate (Costar, Serocluster). H...


Biochemistry 40: 336-44 (2001)


Article DOI: 10.1021/bi000930v
BindingDB Entry DOI: 10.7270/Q2GQ6W3K
More data for this
Ligand-Target Pair