Compile Data Set for Download or QSAR

Found 38 hits of ic50 data for polymerid = 5320   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM155523 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7.10E+3	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	9.90E+3	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.90E+3	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.05E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.28E+4	n/a	n/a	n/a	n/a	n/a	n/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))	BDBM50240715 ((S)-2-Amino-5-but-3-enimidoylamino-pentanoic acid ...) Show SMILES CC=CC(N)=NCCC[C@H](N)C(O)=O |r,w:5.5,1.0| Show InChI InChI=1S/C9H17N3O2/c1-2-4-8(11)12-6-3-5-7(10)9(13)14/h2,4,7H,3,5-6,10H2,1H3,(H2,11,12)(H,13,14)/t7-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM155508 (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	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.31E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents	US Patent	n/a	n/a	1.32E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.34E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.37E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.41E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.77E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	2.12E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.33E+4	n/a	n/a	n/a	n/a	n/a	n/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))	BDBM141899 (US8921421, L-257 | hDDAH inhibitor, 2a) Show SMILES COCCNC(=N)NCCC[C@H](N)C(O)=O |r| 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 antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	PDB US Patent	1.30E+4	n/a	2.90E+4	n/a	n/a	n/a	n/a	7.4	n/a
Christian-Albrechts-Universitaet Zu Kiel US Patent					Assay Description This assay was used to determine the inhibiting effect of the inhibitors in a concentration of 1 mM. A standard incubation mixture consisted of 75 &#...				US Patent US8921421 (2014) BindingDB Entry DOI: 10.7270/Q2GH9GP9
					More data for this Ligand-Target Pair				3D Structure (crystal)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50240959 ((S)-2-Amino-5-[N'-(2-methoxy-ethyl)-guanidino]-pen...) Show SMILES COCCNC(N)=NCCC[C@H](N)C(O)=O |r,w:7.7| 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 antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	MMDB Article PubMed	n/a	n/a	2.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM155524 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.99E+4	n/a	n/a	n/a	n/a	n/a	n/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 (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)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.58E+4	n/a	n/a	n/a	n/a	n/a	n/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))	BDBM50070209 (Aciphex | CHEBI:8768 | LY-307640 | Rabeprazole) Show SMILES COCCCOc1ccnc(C[S+]([O-])c2nc3ccccc3[nH]2)c1C Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Lille Curated by ChEMBL					Assay Description Inhibition of human recombinant DDAH1 reduction in L-citrulline formation using ADMA as substrate				Eur J Med Chem 179: 557-566 (2019) Article DOI: 10.1016/j.ejmech.2019.06.057 BindingDB Entry DOI: 10.7270/Q2XS5ZT5
					More data for this Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50254452 (CHEMBL197234 | N-omega-propargyl-L-arginine) Show SMILES N[C@@H](CCCN=C(N)NCC#C)C(O)=O |r,w:5.4| 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 antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM141900 (US8921421, 3) Show SMILES COCCNC(=N)NCCCCN Show InChI InChI=1S/C8H20N4O/c1-13-7-6-12-8(10)11-5-3-2-4-9/h2-7,9H2,1H3,(H3,10,11,12)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	1.80E+4	n/a	7.00E+4	n/a	n/a	n/a	n/a	7.4	n/a
Christian-Albrechts-Universitaet Zu Kiel US Patent					Assay Description This assay was used to determine the inhibiting effect of the inhibitors in a concentration of 1 mM. A standard incubation mixture consisted of 75 &#...				US Patent US8921421 (2014) BindingDB Entry DOI: 10.7270/Q2GH9GP9
					More data for this Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50255074 ((S)-2-Amino-5-butyrimidoylamino-pentanoic acid | C...) Show SMILES CCCC(N)=NCCC[C@H](N)C(O)=O |r,w:5.5| 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 antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50254449 (CHEMBL456882 | N5-(1-iminopent-3-enyl)-L-ornithine) Show SMILES CCC=CC(N)=NCCC[C@H](N)C(O)=O |r,w:3.3,6.6| Show InChI InChI=1S/C10H19N3O2/c1-2-3-6-9(12)13-7-4-5-8(11)10(14)15/h3,6,8H,2,4-5,7,11H2,1H3,(H2,12,13)(H,14,15)/t8-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50254451 (CHEMBL106423 | N-omega-(but-3-enyl)-L-arginine) Show SMILES N[C@@H](CCCN=C(N)NCCC=C)C(O)=O |r,w:5.4| 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 antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.89E+5	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50240714 ((2S)-5-{[(allylamino)(iminio)methyl]amino}-2-ammon...) Show SMILES N[C@@H](CCCN=C(N)NCC=C)C(O)=O |r,w:5.4| 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 antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.07E+5	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50240716 ((S)-2-Amino-5-(N'-propyl-guanidino)-pentanoic acid...) Show SMILES CCCNC(N)=NCCC[C@H](N)C(O)=O |r,w:6.6| 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 antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.83E+5	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50254450 ((S)-2-Amino-5-propionimidoylamino-pentanoic acid |...) Show SMILES CCC(N)=NCCC[C@H](N)C(O)=O |r,w:4.4| 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 antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human DDAH1 by plate-reader assay				Bioorg Med Chem 16: 10205-9 (2008) Article DOI: 10.1016/j.bmc.2008.10.058 BindingDB Entry DOI: 10.7270/Q23F4PG3
					More data for this Ligand-Target Pair				3D Structure (crystal)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50242405 ((2S)-2-amino-4-sulfanylbutanoic acid | CHEMBL46966...) Show SMILES N[C@@H](CCS)C(O)=O |r| Show InChI InChI=1S/C4H9NO2S/c5-3(1-2-8)4(6)7/h3,8H,1-2,5H2,(H,6,7)/t3-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	6.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Curated by ChEMBL					Assay Description Inhibition of human recombinant DDAH1				J Biol Chem 282: 34684-92 (2007) Article DOI: 10.1074/jbc.M707231200 BindingDB Entry DOI: 10.7270/Q2F47NZ3
					More data for this Ligand-Target Pair				3D Structure (crystal)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50404858 (CHEMBL351569) Show SMILES CCc1nc2ccccc2[nH]1 Show InChI InChI=1S/C9H10N2/c1-2-9-10-7-5-3-4-6-8(7)11-9/h3-6H,2H2,1H3,(H,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Curated by ChEMBL					Assay Description Inhibition of human recombinant His6-tagged DDAH1 expressed in Escherichia coli BL21(DE3) using Nomega,Nomega-dimethyl-L-arginine as substrate after ...				Bioorg Med Chem 20: 5550-8 (2012) Article DOI: 10.1016/j.bmc.2012.07.022 BindingDB Entry DOI: 10.7270/Q2416ZBJ
					More data for this Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50421231 (CHEMBL2087646) Show SMILES NCCSc1nc2ccccc2o1 Show InChI InChI=1S/C9H10N2OS/c10-5-6-13-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5-6,10H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Curated by ChEMBL					Assay Description Inhibition of human recombinant His6-tagged DDAH1 expressed in Escherichia coli BL21(DE3) using Nomega,Nomega-dimethyl-L-arginine as substrate after ...				Bioorg Med Chem 20: 5550-8 (2012) Article DOI: 10.1016/j.bmc.2012.07.022 BindingDB Entry DOI: 10.7270/Q2416ZBJ
					More data for this Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50375814 (CHEMBL260628) Show SMILES CN(CCC[C@H](N)C(O)=O)C(NO)N=O |r| Show InChI InChI=1S/C7H16N4O4/c1-11(7(9-14)10-15)4-2-3-5(8)6(12)13/h5,7,9,14H,2-4,8H2,1H3,(H,12,13)/t5-,7?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human recombinant DDAH1 expressed in Escherichia coli BL21 cells				Bioorg Med Chem 16: 2305-12 (2008) Article DOI: 10.1016/j.bmc.2007.11.066 BindingDB Entry DOI: 10.7270/Q2KW5GXN
					More data for this Ligand-Target Pair
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50049254 ((2S)-2-amino-5-(N-methylcarbamimidamido)pentanoic ...) Show SMILES CN(CCC[C@H](N)C(O)=O)C(N)=N Show InChI InChI=1S/C7H16N4O2/c1-11(7(9)10)4-2-3-5(8)6(12)13/h5H,2-4,8H2,1H3,(H3,9,10)(H,12,13)/t5-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human recombinant DDAH1 expressed in Escherichia coli BL21 cells				Bioorg Med Chem 16: 2305-12 (2008) Article DOI: 10.1016/j.bmc.2007.11.066 BindingDB Entry DOI: 10.7270/Q2KW5GXN
					More data for this Ligand-Target Pair				3D Structure (docked)
N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (Homo sapiens (Human))	BDBM50375815 (CHEMBL408088) Show SMILES CN(CCC[C@H](N)C(O)=O)C(N)=O |r| Show InChI InChI=1S/C7H15N3O3/c1-10(7(9)13)4-2-3-5(8)6(11)12/h5H,2-4,8H2,1H3,(H2,9,13)(H,11,12)/t5-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Christian-Albrechts-University of Kiel Curated by ChEMBL					Assay Description Inhibition of human recombinant DDAH1 expressed in Escherichia coli BL21 cells				Bioorg Med Chem 16: 2305-12 (2008) Article DOI: 10.1016/j.bmc.2007.11.066 BindingDB Entry DOI: 10.7270/Q2KW5GXN
					More data for this Ligand-Target Pair