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Patent code US9011882

Compile Data Set for Download or QSAR
Found 20 hits of Enzyme Inhibition Constant Data   
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
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155523
PNG
(US9011882, Table 1, Compound 18)
Show SMILES COCCNC(=O)Cn1sc2nc(C)cc(C)c2c1=O
Show InChI InChI=1S/C13H17N3O3S/c1-8-6-9(2)15-12-11(8)13(18)16(20-12)7-10(17)14-4-5-19-3/h6H,4-5,7H2,1-3H3,(H,14,17)
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n/an/a 3.30E+3n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM50389868
PNG
(CHEMBL2070857 | US9011882, Table 1, Compound 16)
Show SMILES CCCCNC(=O)Cn1sc2nc(C)cc(C)c2c1=O
Show InChI InChI=1S/C14H19N3O2S/c1-4-5-6-15-11(18)8-17-14(19)12-9(2)7-10(3)16-13(12)20-17/h7H,4-6,8H2,1-3H3,(H,15,18)
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n/an/a 5.10E+3n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155517
PNG
(US9011882, Table 1, Compound 10)
Show SMILES CCOCCCNC(=O)Cn1sc2nc(C)cc(C)c2c1=O
Show InChI InChI=1S/C15H21N3O3S/c1-4-21-7-5-6-16-12(19)9-18-15(20)13-10(2)8-11(3)17-14(13)22-18/h8H,4-7,9H2,1-3H3,(H,16,19)
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n/an/a 7.10E+3n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155515
PNG
(US9011882, Table 1, Compound 8)
Show SMILES CC1CCCC(NC(=O)Cn2sc3nc(C)cc(C)c3c2=O)C1C
Show InChI InChI=1S/C18H25N3O2S/c1-10-6-5-7-14(13(10)4)20-15(22)9-21-18(23)16-11(2)8-12(3)19-17(16)24-21/h8,10,13-14H,5-7,9H2,1-4H3,(H,20,22)
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n/an/a 8.60E+3n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155510
PNG
(US9011882, Table 1, Compound 3)
Show SMILES CP(O)(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C8H8NO2PS/c1-12(10,11)8-9-6-4-2-3-5-7(6)13-8/h2-5H,1H3,(H,10,11)
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n/an/a 9.90E+3n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM34513
PNG
(MLS000118887 | N-[2-(2,5-dimethoxyphenyl)ethyl]-2-...)
Show SMILES COc1ccc(OC)c(CCNC(=O)Cn2sc3nc(C)cc(C)c3c2=O)c1
Show InChI InChI=1S/C20H23N3O4S/c1-12-9-13(2)22-19-18(12)20(25)23(28-19)11-17(24)21-8-7-14-10-15(26-3)5-6-16(14)27-4/h5-6,9-10H,7-8,11H2,1-4H3,(H,21,24)
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n/an/a 9.90E+3n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155521
PNG
(US9011882, Table 1, Compound 14)
Show SMILES CCOc1ccc(CCNC(=O)Cn2sc3nc(C)cc(C)c3c2=O)cc1
Show InChI InChI=1S/C20H23N3O3S/c1-4-26-16-7-5-15(6-8-16)9-10-21-17(24)12-23-20(25)18-13(2)11-14(3)22-19(18)27-23/h5-8,11H,4,9-10,12H2,1-3H3,(H,21,24)
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n/an/a 1.05E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155519
PNG
(US9011882, Table 1, Compound 12)
Show SMILES Cc1cc(C)c2c(n1)sn(CC(=O)NCc1ccc3OCOc3c1)c2=O
Show InChI InChI=1S/C18H17N3O4S/c1-10-5-11(2)20-17-16(10)18(23)21(26-17)8-15(22)19-7-12-3-4-13-14(6-12)25-9-24-13/h3-6H,7-9H2,1-2H3,(H,19,22)
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n/an/a 1.10E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155522
PNG
(US9011882, Table 1, Compound 17)
Show SMILES Cc1cc(C)c2c(n1)sn(CC(=O)NCCC1=CCCCC1)c2=O |t:17|
Show InChI InChI=1S/C18H23N3O2S/c1-12-10-13(2)20-17-16(12)18(23)21(24-17)11-15(22)19-9-8-14-6-4-3-5-7-14/h6,10H,3-5,7-9,11H2,1-2H3,(H,19,22)
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n/an/a 1.18E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155516
PNG
(US9011882, Table 1, Compound 9)
Show SMILES Cc1cc(C)c2c(n1)sn(CC(=O)NCCCSC1CCCCC1)c2=O
Show InChI InChI=1S/C19H27N3O2S2/c1-13-11-14(2)21-18-17(13)19(24)22(26-18)12-16(23)20-9-6-10-25-15-7-4-3-5-8-15/h11,15H,3-10,12H2,1-2H3,(H,20,23)
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n/an/a 1.28E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155508
PNG
(US9011882, Table 1, Compound 1)
Show SMILES O=C1CC(N2CCCCCC2)C(=O)N1c1cccc2ccccc12
Show InChI InChI=1S/C20H22N2O2/c23-19-14-18(21-12-5-1-2-6-13-21)20(24)22(19)17-11-7-9-15-8-3-4-10-16(15)17/h3-4,7-11,18H,1-2,5-6,12-14H2
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n/an/a 1.31E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM46658
PNG
(1,2-benzothiazol-3-one | MLS-0254244.0001 | US9011...)
Show SMILES O=c1[nH]sc2ccccc12
Show InChI InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)
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n/an/a 1.32E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155520
PNG
(US9011882, Table 1, Compound 13)
Show SMILES Cc1cc(C)c2c(n1)sn(CC(=O)NCCc1ccc(Cl)cc1)c2=O
Show InChI InChI=1S/C18H18ClN3O2S/c1-11-9-12(2)21-17-16(11)18(24)22(25-17)10-15(23)20-8-7-13-3-5-14(19)6-4-13/h3-6,9H,7-8,10H2,1-2H3,(H,20,23)
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n/an/a 1.34E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155514
PNG
(US9011882, Table 1, Compound 7)
Show SMILES CC(NC(=O)Cn1sc2nc(C)cc(C)c2c1=O)c1ccccc1
Show InChI InChI=1S/C18H19N3O2S/c1-11-9-12(2)19-17-16(11)18(23)21(24-17)10-15(22)20-13(3)14-7-5-4-6-8-14/h4-9,13H,10H2,1-3H3,(H,20,22)
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n/an/a 1.37E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155518
PNG
(US9011882, Table 1, Compound 11)
Show SMILES CC(CCc1ccccc1)NC(=O)Cn1sc2nc(C)cc(C)c2c1=O
Show InChI InChI=1S/C20H23N3O2S/c1-13-11-15(3)22-19-18(13)20(25)23(26-19)12-17(24)21-14(2)9-10-16-7-5-4-6-8-16/h4-8,11,14H,9-10,12H2,1-3H3,(H,21,24)
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n/an/a 1.41E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155512
PNG
(US9011882, Table 1, Compound 5)
Show SMILES N\C=C1/C=C(OC1=S)c1ccccc1 |c:3|
Show InChI InChI=1S/C11H9NOS/c12-7-9-6-10(13-11(9)14)8-4-2-1-3-5-8/h1-7H,12H2/b9-7+
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n/an/a 1.77E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155511
PNG
(US9011882, Table 1, Compound 4)
Show SMILES Cc1ccc(NC(=O)\C=C\C(N)=O)cc1
Show InChI InChI=1S/C11H12N2O2/c1-8-2-4-9(5-3-8)13-11(15)7-6-10(12)14/h2-7H,1H3,(H2,12,14)(H,13,15)/b7-6+
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n/an/a 2.12E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155509
PNG
(US9011882, Table 1, Compound 2)
Show SMILES OC(=O)c1ccc(cc1)N1C(=O)C=CC1=O |c:13|
Show InChI InChI=1S/C11H7NO4/c13-9-5-6-10(14)12(9)8-3-1-7(2-4-8)11(15)16/h1-6H,(H,15,16)
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n/an/a 2.33E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155524
PNG
(US9011882, Table 1, Compound 19)
Show SMILES Cc1cc(C)c2c(n1)sn(CC(=O)NCc1ccccc1Cl)c2=O
Show InChI InChI=1S/C17H16ClN3O2S/c1-10-7-11(2)20-16-15(10)17(23)21(24-16)9-14(22)19-8-12-5-3-4-6-13(12)18/h3-7H,8-9H2,1-2H3,(H,19,22)
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n/an/a 3.99E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1


(Homo sapiens (Human))		BDBM155513
PNG
(US9011882, Table 1, Compound 6)
Show SMILES Cc1ccc(cc1)-c1ccc(CCC(O)=O)o1
Show InChI InChI=1S/C14H14O3/c1-10-2-4-11(5-3-10)13-8-6-12(17-13)7-9-14(15)16/h2-6,8H,7,9H2,1H3,(H,15,16)
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n/an/a 4.58E+4n/an/an/an/an/an/a



The Board of Trustees of the Leland Stanford Junior University

US Patent


Assay Description
The L-citrulline assay was based upon an original test-tube method developed by Prescott and Jones in 1969 (Prescott, L. M. & Jones, M. E. Modified m...

US Patent US9011882 (2015)


BindingDB Entry DOI: 10.7270/Q2W957XP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%