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Compile Data Set for Download or QSAR

Found 13 hits of ph data with Target = 'Dimethylarginine dimethylaminohydrolase 1 (DDAH)'   
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
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM235685
PNG
(hDDAH inhibitor, 1a)
Show SMILES N[C@@H](CCCNC(=N)CC=C)C(O)=O
Show InChI InChI=1S/C9H17N3O2/c1-2-4-8(11)12-6-3-5-7(10)9(13)14/h2,7H,1,3-6,10H2,(H2,11,12)(H,13,14)/t7-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.00E+3 -33.8n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM141899
PNG
(US8921421, L-257 | hDDAH inhibitor, 2a)
Show SMILES COCCNC(=N)NCCC[C@H](N)C(O)=O
Show InChI InChI=1S/C9H20N4O3/c1-16-6-5-13-9(11)12-4-2-3-7(10)8(14)15/h7H,2-6,10H2,1H3,(H,14,15)(H3,11,12,13)/t7-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
1.30E+4 -29.0n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM235691
PNG
(hDDAH inhibitor, 2e)
Show SMILES N[C@@H](CCCNC(=N)NCC#C)C(O)=O
Show InChI InChI=1S/C9H16N4O2/c1-2-5-12-9(11)13-6-3-4-7(10)8(14)15/h1,7H,3-6,10H2,(H,14,15)(H3,11,12,13)/t7-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.70E+4 -28.3n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM152700
PNG
((S)-2-Amino-5-butyrimidamidopentanoic acid (9) | h...)
Show SMILES CCCC(=N)NCCC[C@H](N)C(O)=O
Show InChI InChI=1S/C9H19N3O2/c1-2-4-8(11)12-6-3-5-7(10)9(13)14/h7H,2-6,10H2,1H3,(H2,11,12)(H,13,14)/t7-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.20E+4 -26.7n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM235686
PNG
(hDDAH inhibitor, 1c)
Show SMILES C\C=C\CC(=N)NCCC[C@H](N)C(O)=O
Show InChI InChI=1S/C10H19N3O2/c1-2-3-6-9(12)13-7-4-5-8(11)10(14)15/h2-3,8H,4-7,11H2,1H3,(H2,12,13)(H,14,15)/b3-2+/t8-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.60E+4 -26.4n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM235690
PNG
(hDDAH inhibitor, 2d)
Show SMILES N[C@@H](CCCNC(=N)NCCC=C)C(O)=O
Show InChI InChI=1S/C10H20N4O2/c1-2-3-6-13-10(12)14-7-4-5-8(11)9(15)16/h2,8H,1,3-7,11H2,(H,15,16)(H3,12,13,14)/t8-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.70E+4 -25.2n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM235689
PNG
(hDDAH inhibitor, 2c)
Show SMILES N[C@@H](CCCNC(=N)NCC=C)C(O)=O
Show InChI InChI=1S/C9H18N4O2/c1-2-5-12-9(11)13-6-3-4-7(10)8(14)15/h2,7H,1,3-6,10H2,(H,14,15)(H3,11,12,13)/t7-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.80E+4 -25.2n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM235688
PNG
(hDDAH inhibitor, 2b)
Show SMILES CCCNC(=N)NCCC[C@H](N)C(O)=O
Show InChI InChI=1S/C9H20N4O2/c1-2-5-12-9(11)13-6-3-4-7(10)8(14)15/h7H,2-6,10H2,1H3,(H,14,15)(H3,11,12,13)/t7-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
9.00E+4 -24.0n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM152699
PNG
((S)-2-Amino-5-propionimidamidopentanoic acid (8) |...)
Show SMILES CCC(=N)NCCC[C@H](N)C(O)=O
Show InChI InChI=1S/C8H17N3O2/c1-2-7(10)11-5-3-4-6(9)8(12)13/h6H,2-5,9H2,1H3,(H2,10,11)(H,12,13)/t6-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
1.45E+5 -22.8n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM60960
PNG
(hDDAH inhibitor, 2f)
Show SMILES N[C@@H](CCCNC(=N)NCC(F)(F)F)C(O)=O
Show InChI InChI=1S/C8H15F3N4O2/c9-8(10,11)4-15-7(13)14-3-1-2-5(12)6(16)17/h5H,1-4,12H2,(H,16,17)(H3,13,14,15)/t5-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.06E+5 -19.1n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM235693
PNG
(hDDAH inhibitor, 2h)
Show SMILES N[C@@H](CCCNC(=N)NCCC(N)=O)C(O)=O
Show InChI InChI=1S/C9H19N5O3/c10-6(8(16)17)2-1-4-13-9(12)14-5-3-7(11)15/h6H,1-5,10H2,(H2,11,15)(H,16,17)(H3,12,13,14)/t6-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
7.64E+5 -18.5n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM152697
PNG
((S)-5-Acetimidamido-2-aminopentanoic acid (4, L-NI...)
Show SMILES CC(=N)NCCC[C@H](N)C(O)=O
Show InChI InChI=1S/C7H15N3O2/c1-5(8)10-4-2-3-6(9)7(11)12/h6H,2-4,9H2,1H3,(H2,8,10)(H,11,12)/t6-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
1.16E+6 -17.4n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair
Dimethylarginine dimethylaminohydrolase 1 (DDAH)


(Homo sapiens (Human))
BDBM235692
PNG
(hDDAH inhibitor, 2g)
Show SMILES N[C@@H](CCCNC(=N)N[N+]([O-])=O)C(O)=O
Show InChI InChI=1S/C6H13N5O4/c7-4(5(12)13)2-1-3-9-6(8)10-11(14)15/h4H,1-3,7H2,(H,12,13)(H3,8,9,10)/t4-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
DrugBank
KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
1.97E+6 -16.1n/an/an/an/an/a7.437



Christian-Albrechts-University



Assay Description
A colorimetric assay was carried out in 150 μL 50 mM potassium phosphate buffer pH 7.4 containing 4 μg of recombinant hDDAH-1 and varying c...


J Enzyme Inhib Med Chem 27: 24-8 (2012)


Article DOI: 10.3109/14756366.2011.573480
BindingDB Entry DOI: 10.7270/Q24B3064
More data for this
Ligand-Target Pair