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Compile Data Set for Download or QSAR

Found 6 hits of ph data with Target = 'Uracil-DNA glycosylase (UNG)'   
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
Uracil-DNA glycosylase (UNG)


(Homo sapiens (Human))
BDBM36456
PNG
(6-[3-(Aminooxypropylamino)methyl]uracil, dihydroch...)
Show SMILES NOCCCNCc1cc(=O)[nH]c(=O)[nH]1
Show InChI InChI=1S/C8H14N4O3/c9-15-3-1-2-10-5-6-4-7(13)12-8(14)11-6/h4,10H,1-3,5,9H2,(H2,11,12,13,14)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
7.00E+5n/an/an/an/an/an/a8.0n/a



Johns Hopkins University



Assay Description
Inhibition of human uracil DNA glycosylase using high-throughput fluorescent molecular beacon DNA substrate.


Nat Chem Biol 5: 407-13 (2009)


Article DOI: 10.1038/nchembio.163
BindingDB Entry DOI: 10.7270/Q2W37TP8
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Uracil-DNA glycosylase (UNG)


(Homo sapiens (Human))
BDBM36457
PNG
(3-[(3-Aminopropoxyimino)methyl]uracil, hydrochlori...)
Show SMILES NCCCO\N=C\c1cc(=O)[nH]c(=O)[nH]1
Show InChI InChI=1S/C8H12N4O3/c9-2-1-3-15-10-5-6-4-7(13)12-8(14)11-6/h4-5H,1-3,9H2,(H2,11,12,13,14)/b10-5+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.50E+5n/an/an/an/an/an/a8.0n/a



Johns Hopkins University



Assay Description
Inhibition of human uracil DNA glycosylase using high-throughput fluorescent molecular beacon DNA substrate.


Nat Chem Biol 5: 407-13 (2009)


Article DOI: 10.1038/nchembio.163
BindingDB Entry DOI: 10.7270/Q2W37TP8
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Uracil-DNA glycosylase (UNG)


(Homo sapiens (Human))
BDBM36455
PNG
(6-[4-[(3-Carboxybenzylamino)butylamino]methyl]urac...)
Show SMILES OC(=O)c1cccc(CNCCCCNCc2cc(=O)[nH]c(=O)[nH]2)c1
Show InChI InChI=1S/C17H22N4O4/c22-15-9-14(20-17(25)21-15)11-19-7-2-1-6-18-10-12-4-3-5-13(8-12)16(23)24/h3-5,8-9,18-19H,1-2,6-7,10-11H2,(H,23,24)(H2,20,21,22,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
MMDB
PC cid
PC sid
PDB
UniChem
MMDB
PDB
Article
PubMed
n/an/a 3.15E+5n/an/an/an/a8.0n/a



Johns Hopkins University



Assay Description
Inhibition of human uracil DNA glycosylase using high-throughput fluorescent molecular beacon DNA substrate.


Nat Chem Biol 5: 407-13 (2009)


Article DOI: 10.1038/nchembio.163
BindingDB Entry DOI: 10.7270/Q2W37TP8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Uracil-DNA glycosylase (UNG)


(Homo sapiens (Human))
BDBM36453
PNG
(6-[3-[(3-Carboxy-benzylidene)aminooxypropylamino]-...)
Show SMILES OC(=O)c1cccc(\C=N\OCCCNCc2cc(=O)[nH]c(=O)[nH]2)c1
Show InChI InChI=1S/C16H18N4O5/c21-14-8-13(19-16(24)20-14)10-17-5-2-6-25-18-9-11-3-1-4-12(7-11)15(22)23/h1,3-4,7-9,17H,2,5-6,10H2,(H,22,23)(H2,19,20,21,24)/b18-9+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
MMDB
PC cid
PC sid
PDB
UniChem
MMDB
PDB
Article
PubMed
n/an/a 1.30E+3n/an/an/an/a8.0n/a



Johns Hopkins University



Assay Description
Inhibition of human uracil DNA glycosylase using high-throughput fluorescent molecular beacon DNA substrate.


Nat Chem Biol 5: 407-13 (2009)


Article DOI: 10.1038/nchembio.163
BindingDB Entry DOI: 10.7270/Q2W37TP8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Uracil-DNA glycosylase (UNG)


(Homo sapiens (Human))
BDBM36452
PNG
(6-[[(3-Carboxy-benzylidene)-aminooxy]ethoxyimino]m...)
Show SMILES OC(=O)c1cccc(\C=N\OCCO\N=C\c2cc(=O)[nH]c(=O)[nH]2)c1
Show InChI InChI=1S/C15H14N4O6/c20-13-7-12(18-15(23)19-13)9-17-25-5-4-24-16-8-10-2-1-3-11(6-10)14(21)22/h1-3,6-9H,4-5H2,(H,21,22)(H2,18,19,20,23)/b16-8+,17-9+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
DrugBank
MMDB
PDB
Article
PubMed
n/an/a 4.00E+4n/an/an/an/a8.0n/a



Johns Hopkins University



Assay Description
Inhibition of human uracil DNA glycosylase using high-throughput fluorescent molecular beacon DNA substrate.


Nat Chem Biol 5: 407-13 (2009)


Article DOI: 10.1038/nchembio.163
BindingDB Entry DOI: 10.7270/Q2W37TP8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Uracil-DNA glycosylase (UNG)


(Homo sapiens (Human))
BDBM36454
PNG
(6-[[3-(3-Carboxybenzyl)aminopropylimino]methyl]ura...)
Show SMILES OC(=O)c1cccc(CNCCCO\N=C\c2cc(=O)[nH]c(=O)[nH]2)c1
Show InChI InChI=1S/C16H18N4O5/c21-14-8-13(19-16(24)20-14)10-18-25-6-2-5-17-9-11-3-1-4-12(7-11)15(22)23/h1,3-4,7-8,10,17H,2,5-6,9H2,(H,22,23)(H2,19,20,21,24)/b18-10+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 1.00E+5n/an/an/an/a8.0n/a



Johns Hopkins University



Assay Description
Inhibition of human uracil DNA glycosylase using high-throughput fluorescent molecular beacon DNA substrate.


Nat Chem Biol 5: 407-13 (2009)


Article DOI: 10.1038/nchembio.163
BindingDB Entry DOI: 10.7270/Q2W37TP8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)