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Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'HDM2-p53 protein' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
HDM2-p53 protein


(Homo sapiens (Human))
BDBM81636
PNG
(BZD Scaffold, 6)
Show SMILES [O-]C(=O)C(N1C(c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H15Cl2IN2O4/c24-14-5-1-12(2-6-14)19-21(29)27-18-10-9-16(26)11-17(18)22(30)28(19)20(23(31)32)13-3-7-15(25)8-4-13/h1-11,19-20H,(H,27,29)(H,31,32)/p-1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 400n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development



Assay Description
Binding assay using 1,4-benzodiazepine-2,5-dione (BZD) scaffold and HDM2-p53 protein.


Chem Biol Drug Des 67: 201-5 (2006)

More data for this
Ligand-Target Pair
HDM2-p53 protein


(Homo sapiens (Human))
BDBM81632
PNG
(BZD Scaffold, 2)
Show SMILES CC(C)c1ccc2NC(=O)C(N(C(C([O-])=O)c3ccc(Cl)cc3)C(=O)c2c1)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H22Cl2N2O4/c1-14(2)17-7-12-21-20(13-17)25(32)30(23(26(33)34)16-5-10-19(28)11-6-16)22(24(31)29-21)15-3-8-18(27)9-4-15/h3-14,22-23H,1-2H3,(H,29,31)(H,33,34)/p-1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development



Assay Description
Binding assay using 1,4-benzodiazepine-2,5-dione (BZD) scaffold and HDM2-p53 protein.


Chem Biol Drug Des 67: 201-5 (2006)

More data for this
Ligand-Target Pair
HDM2-p53 protein


(Homo sapiens (Human))
BDBM81635
PNG
(BZD Scaffold, 5)
Show SMILES [O-]C(=O)C(N1C(c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccccc1
Show InChI InChI=1S/C23H16ClIN2O4/c24-15-8-6-14(7-9-15)19-21(28)26-18-11-10-16(25)12-17(18)22(29)27(19)20(23(30)31)13-4-2-1-3-5-13/h1-12,19-20H,(H,26,28)(H,30,31)/p-1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development



Assay Description
Binding assay using 1,4-benzodiazepine-2,5-dione (BZD) scaffold and HDM2-p53 protein.


Chem Biol Drug Des 67: 201-5 (2006)

More data for this
Ligand-Target Pair
HDM2-p53 protein


(Homo sapiens (Human))
BDBM81634
PNG
(BZD Scaffold, 4)
Show SMILES [O-]C(=O)C(N1C(c2ccc(cc2)C(F)(F)F)C(=O)Nc2ccc(I)cc2C1=O)c1ccccc1
Show InChI InChI=1S/C24H16F3IN2O4/c25-24(26,27)15-8-6-14(7-9-15)19-21(31)29-18-11-10-16(28)12-17(18)22(32)30(19)20(23(33)34)13-4-2-1-3-5-13/h1-12,19-20H,(H,29,31)(H,33,34)/p-1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development



Assay Description
Binding assay using 1,4-benzodiazepine-2,5-dione (BZD) scaffold and HDM2-p53 protein.


Chem Biol Drug Des 67: 201-5 (2006)

More data for this
Ligand-Target Pair
HDM2-p53 protein


(Homo sapiens (Human))
BDBM81633
PNG
(BZD Scaffold, 3)
Show SMILES [O-]C(=O)C(N1C(c2ccccc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccccc1
Show InChI InChI=1S/C23H17IN2O4/c24-16-11-12-18-17(13-16)22(28)26(20(23(29)30)15-9-5-2-6-10-15)19(21(27)25-18)14-7-3-1-4-8-14/h1-13,19-20H,(H,25,27)(H,29,30)/p-1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 2.90E+4n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development



Assay Description
Binding assay using 1,4-benzodiazepine-2,5-dione (BZD) scaffold and HDM2-p53 protein.


Chem Biol Drug Des 67: 201-5 (2006)

More data for this
Ligand-Target Pair
HDM2-p53 protein


(Homo sapiens (Human))
BDBM81631
PNG
(BZD Scaffold, 1)
Show SMILES [O-]C(=O)C(N1C(c2ccccc2)C(=O)Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C23H18N2O4/c26-21-19(15-9-3-1-4-10-15)25(20(23(28)29)16-11-5-2-6-12-16)22(27)17-13-7-8-14-18(17)24-21/h1-14,19-20H,(H,24,26)(H,28,29)/p-1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a>1.25E+5n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development



Assay Description
Binding assay using 1,4-benzodiazepine-2,5-dione (BZD) scaffold and HDM2-p53 protein.


Chem Biol Drug Des 67: 201-5 (2006)

More data for this
Ligand-Target Pair