Compile Data Set for Download or QSAR

Found 439 hits with Last Name = 'duvall' and Initial = 'b'   

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
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50117763 (CHEMBL3613921 | US9505753, 5u) Show SMILES Oc1nn(Cc2cccc3ccccc23)c(=O)[nH]c1=O Show InChI InChI=1S/C14H11N3O3/c18-12-13(19)16-17(14(20)15-12)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,16,19)(H,15,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Competitive inhibition of recombinant human DAAO expressed in HEK cells by double reciprocal plot analysis in presence of D-serine				J Med Chem 58: 7258-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00482 BindingDB Entry DOI: 10.7270/Q2SF2XZQ
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM108460 (CHEMBL2178393 | US11191732, Example 1 | US8604016,...) Show SMILES Nc1nnc(CCSCCc2nnc(NC(=O)Cc3ccccc3)s2)s1 Show InChI InChI=1S/C16H18N6OS3/c17-15-21-19-13(25-15)6-8-24-9-7-14-20-22-16(26-14)18-12(23)10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,17,21)(H,18,22,23)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Uncompetitive inhibition of human kidney glutaminase (124 to 669) assessed as reduction of glutamine hydrolysis by double-reciprocal plot analysis				J Med Chem 55: 10551-63 (2012) Article DOI: 10.1021/jm301191p BindingDB Entry DOI: 10.7270/Q2VD70M7
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Sus scrofa (pig))	BDBM50031467 (5-HYDROXY-2-(HYDROXYMETHYL)-4H-PYRAN-4-ONE | 5-Hyd...) Show SMILES OCc1cc(=O)c(O)co1 Show InChI InChI=1S/C6H6O4/c7-2-4-1-5(8)6(9)3-10-4/h1,3,7,9H,2H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Competitive inhibition of pig kidney DAAO using D-Alanine as substrate by Michaelis-Menten plot analysis				Bioorg Med Chem Lett 23: 3910-3 (2013) Article DOI: 10.1016/j.bmcl.2013.04.062 BindingDB Entry DOI: 10.7270/Q2K35W2G
					More data for this Ligand-Target Pair
Cytidine deaminase (Homo sapiens (Human))	BDBM50007037 (CHEBI:23774 | CHEMBL3237555) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1CCC(=O)NC1=O |r| Show InChI InChI=1S/C9H14N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4,6-8,12,14-15H,1-3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human cytidine deaminase by spectrophotometrically				J Med Chem 57: 2582-8 (2014) Article DOI: 10.1021/jm401856k BindingDB Entry DOI: 10.7270/Q2NK3GJG
					More data for this Ligand-Target Pair
Cytidine deaminase (Homo sapiens (Human))	BDBM50007025 (TETRAHYDROURIDINE) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1CC[C@@H](O)NC1=O |r| Show InChI InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)/t4-,5-,6-,7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	4.40E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human cytidine deaminase by spectrophotometrically				J Med Chem 57: 2582-8 (2014) Article DOI: 10.1021/jm401856k BindingDB Entry DOI: 10.7270/Q2NK3GJG
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM50503299 (CHEMBL4538736) Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2ccc(C[C@@H]3CC[C@@H](C3)c3nnc(NC(=O)Cc4ccccn4)s3)nn2)c1 |r| Show InChI InChI=1S/C28H26F3N7O3S/c29-28(30,31)41-22-6-3-4-17(14-22)15-24(39)33-23-10-9-21(35-36-23)13-18-7-8-19(12-18)26-37-38-27(42-26)34-25(40)16-20-5-1-2-11-32-20/h1-6,9-11,14,18-19H,7-8,12-13,15-16H2,(H,33,36,39)(H,34,38,40)/t18-,19+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of kidney-type glutaminase in human BT20 cells assessed as reduction in glutamate level				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM50503300 (CHEMBL4547874) Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2ccc(C[C@H]3C[C@H](C3)c3nnc(NC(=O)Cc4ccccn4)s3)nn2)c1 |r,wD:21.23,19.18,(91.7,-43.25,;90.36,-44.02,;90.37,-45.56,;91.69,-44.79,;89.02,-43.26,;87.7,-44.03,;87.71,-45.58,;86.37,-46.35,;85.03,-45.58,;85.04,-44.04,;83.7,-43.27,;82.37,-44.04,;82.37,-45.58,;81.03,-43.27,;79.7,-44.04,;79.7,-45.58,;78.36,-46.36,;77.04,-45.58,;75.71,-46.35,;74.37,-45.57,;73.98,-44.09,;72.49,-44.49,;72.89,-45.97,;71.16,-43.72,;70.68,-42.25,;69.14,-42.25,;68.67,-43.72,;67.32,-44.48,;65.99,-43.7,;66,-42.16,;64.65,-44.46,;63.33,-43.68,;63.35,-42.14,;62.02,-41.36,;60.68,-42.12,;60.67,-43.67,;62,-44.44,;69.92,-44.63,;77.03,-44.04,;78.35,-43.27,;86.36,-43.27,)| Show InChI InChI=1S/C27H24F3N7O3S/c28-27(29,30)40-21-6-3-4-16(13-21)14-23(38)32-22-8-7-20(34-35-22)12-17-10-18(11-17)25-36-37-26(41-25)33-24(39)15-19-5-1-2-9-31-19/h1-9,13,17-18H,10-12,14-15H2,(H,32,35,38)(H,33,37,39)/t17-,18+	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of kidney-type glutaminase in human BT20 cells assessed as reduction in glutamate level				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 [44-750] (Homo sapiens (Human))	BDBM17659 ((R,S)-2-phosphonomethylpentanedioic acid | 2-(phos...) Show SMILES OC(=O)CCC(CP(O)(O)=O)C(O)=O Show InChI InChI=1S/C6H11O7P/c7-5(8)2-1-4(6(9)10)3-14(11,12)13/h4H,1-3H2,(H,7,8)(H,9,10)(H2,11,12,13)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	0.300	n/a	n/a	n/a	n/a	7.4	37
MGI Pharma					Assay Description GCPII activity in vitro is monitored through the hydrolysis [3H]NAAG to NAA and [3H]Glu. The radioactivity-based assay was miniaturized to a 96-well ...				J Med Chem 49: 2876-85 (2006) Article DOI: 10.1021/jm051019l BindingDB Entry DOI: 10.7270/Q28C9TJD
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM50503313 (CHEMBL4454263) Show SMILES Cn1ccc(CC(=O)Nc2nnc(s2)[C@H]2C[C@]3(C[C@@H](C3)c3nnc(NC(=O)Cc4ccn(C)n4)s3)C2)n1 |r,wU:16.17,18.21,wD:14.14,(22.28,-3.9,;23.81,-3.75,;24.59,-2.42,;26.09,-2.75,;26.25,-4.29,;27.58,-5.07,;28.91,-4.31,;28.93,-2.77,;30.24,-5.09,;31.58,-4.33,;32.06,-2.86,;33.6,-2.86,;34.08,-4.33,;32.83,-5.23,;35.41,-5.09,;35.8,-6.58,;37.29,-6.19,;37.69,-7.68,;39.17,-7.28,;38.78,-5.79,;40.51,-8.05,;41.75,-7.14,;43,-8.05,;42.52,-9.51,;43.84,-10.28,;45.18,-9.52,;45.19,-7.98,;46.51,-10.29,;47.85,-9.53,;48.01,-7.99,;49.52,-7.67,;50.28,-9.01,;51.82,-9.17,;49.25,-10.15,;40.98,-9.51,;36.89,-4.7,;24.83,-4.9,)| Show InChI InChI=1S/C23H26N10O2S2/c1-32-5-3-15(30-32)7-17(34)24-21-28-26-19(36-21)13-9-23(10-13)11-14(12-23)20-27-29-22(37-20)25-18(35)8-16-4-6-33(2)31-16/h3-6,13-14H,7-12H2,1-2H3,(H,24,28,34)(H,25,29,35)/t13-,14-,23-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of kidney-type glutaminase in human BT20 cells assessed as reduction in glutamate level				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50304738 (2-(3-((S)-1-carboxy-3-methylbutyl)ureido)pentanedi...) Show SMILES CC(C)C[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C12H20N2O7/c1-6(2)5-8(11(19)20)14-12(21)13-7(10(17)18)3-4-9(15)16/h6-8H,3-5H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)(H2,13,14,21)/t7-,8-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Biotechnology of the Czech Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...				Bioorg Med Chem 27: 255-264 (2019) Article DOI: 10.1016/j.bmc.2018.11.022 BindingDB Entry DOI: 10.7270/Q2F47SC4
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50503760 (CHEMBL4442450) Show SMILES CC(C)C[C@H](NC(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C12H19NO8/c1-6(2)5-7(10(16)17)13-12(20)21-8(11(18)19)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	0.650	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Biotechnology of the Czech Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...				Bioorg Med Chem 27: 255-264 (2019) Article DOI: 10.1016/j.bmc.2018.11.022 BindingDB Entry DOI: 10.7270/Q2F47SC4
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50392045 (CHEMBL2152561) Show SMILES OC(=O)c1cccc(c1)-c1cccc(CCS)c1C(O)=O Show InChI InChI=1S/C16H14O4S/c17-15(18)12-5-1-4-11(9-12)13-6-2-3-10(7-8-21)14(13)16(19)20/h1-6,9,21H,7-8H2,(H,17,18)(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant GCP2 using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate by microplate assay				J Med Chem 55: 5922-32 (2012) Article DOI: 10.1021/jm300488m BindingDB Entry DOI: 10.7270/Q21J9BWN
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50392040 (CHEMBL2152556) Show SMILES OC(=O)c1cccc(COc2ccc(CS)cc2C(O)=O)c1 Show InChI InChI=1S/C16H14O5S/c17-15(18)12-3-1-2-10(6-12)8-21-14-5-4-11(9-22)7-13(14)16(19)20/h1-7,22H,8-9H2,(H,17,18)(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant GCP2 using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate by microplate assay				J Med Chem 55: 5922-32 (2012) Article DOI: 10.1021/jm300488m BindingDB Entry DOI: 10.7270/Q21J9BWN
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM50503298 (CHEMBL4462146) Show SMILES Cn1ccc(CC(=O)Nc2nnc(s2)[C@H]2C[C@@]3(C[C@@H](C3)c3nnc(NC(=O)Cc4ccn(C)n4)s3)C2)n1 |r,wU:14.14,16.38,wD:18.21,(1.74,-4.96,;3.28,-4.81,;4.06,-3.49,;5.56,-3.82,;5.71,-5.35,;7.04,-6.13,;8.38,-5.37,;8.39,-3.83,;9.71,-6.15,;11.05,-5.39,;11.53,-3.92,;13.07,-3.92,;13.54,-5.39,;12.3,-6.29,;14.87,-6.16,;16.35,-5.76,;16.76,-7.26,;18.24,-6.86,;18.64,-8.34,;17.15,-8.74,;19.98,-9.11,;21.22,-8.21,;22.47,-9.11,;21.99,-10.58,;23.31,-11.35,;24.65,-10.58,;24.65,-9.04,;25.98,-11.36,;27.32,-10.59,;27.48,-9.05,;28.99,-8.74,;29.75,-10.07,;31.28,-10.24,;28.72,-11.21,;20.45,-10.58,;15.27,-7.64,;4.3,-5.97,)| Show InChI InChI=1S/C23H26N10O2S2/c1-32-5-3-15(30-32)7-17(34)24-21-28-26-19(36-21)13-9-23(10-13)11-14(12-23)20-27-29-22(37-20)25-18(35)8-16-4-6-33(2)31-16/h3-6,13-14H,7-12H2,1-2H3,(H,24,28,34)(H,25,29,35)/t13-,14-,23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of kidney-type glutaminase in human BT20 cells assessed as reduction in glutamate level				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM109086 (US10793535, Cmpd ID 727 | US8604016, 670 | US99382...) Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)c1 Show InChI InChI=1S/C26H24F3N7O3S/c27-26(28,29)39-20-9-5-6-17(14-20)15-22(37)31-21-12-11-18(33-34-21)7-1-2-10-24-35-36-25(40-24)32-23(38)16-19-8-3-4-13-30-19/h3-6,8-9,11-14H,1-2,7,10,15-16H2,(H,31,34,37)(H,32,36,38)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of GAC (unknown origin) assessed as NADH formation using 10 mM glutamine as substrate preincubated for 60 mins				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM416666 ((2S)-2-Methoxy-2-[3-methoxy-5-(trifluoromethoxy)ph...) Show SMILES CO[C@H](C(=O)Nc1nnc(N[C@@H]2CCN(C2)c2cccnn2)s1)c1cc(OC)cc(OC(F)(F)F)c1 |r| Show InChI InChI=1S/C21H22F3N7O4S/c1-33-14-8-12(9-15(10-14)35-21(22,23)24)17(34-2)18(32)27-20-30-29-19(36-20)26-13-5-7-31(11-13)16-4-3-6-25-28-16/h3-4,6,8-10,13,17H,5,7,11H2,1-2H3,(H,26,29)(H,27,30,32)/t13-,17+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human KGA (63 to 669 residues) preincubated for 15 mins using 50 mM glutamine as substrate by resorufin dye based assay				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM416667 ((2R)-2-Methoxy-2-[3-methoxy-5-(trifluoromethoxy)ph...) Show SMILES CO[C@@H](C(=O)Nc1nnc(N[C@@H]2CCN(C2)c2cccnn2)s1)c1cc(OC)cc(OC(F)(F)F)c1 |r| Show InChI InChI=1S/C21H22F3N7O4S/c1-33-14-8-12(9-15(10-14)35-21(22,23)24)17(34-2)18(32)27-20-30-29-19(36-20)26-13-5-7-31(11-13)16-4-3-6-25-28-16/h3-4,6,8-10,13,17H,5,7,11H2,1-2H3,(H,26,29)(H,27,30,32)/t13-,17-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human KGA (63 to 669 residues) preincubated for 15 mins using 50 mM glutamine as substrate by resorufin dye based assay				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50392046 (CHEMBL2152562) Show SMILES OC(=O)c1ccc(cc1)-c1cccc(CCS)c1C(O)=O Show InChI InChI=1S/C16H14O4S/c17-15(18)12-6-4-10(5-7-12)13-3-1-2-11(8-9-21)14(13)16(19)20/h1-7,21H,8-9H2,(H,17,18)(H,19,20)	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	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant GCP2 using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate by microplate assay				J Med Chem 55: 5922-32 (2012) Article DOI: 10.1021/jm300488m BindingDB Entry DOI: 10.7270/Q21J9BWN
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50503756 (CHEMBL4473741) Show SMILES CC(C)C[C@@H](NC(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C12H19NO8/c1-6(2)5-7(10(16)17)13-12(20)21-8(11(18)19)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	8.90	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Biotechnology of the Czech Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...				Bioorg Med Chem 27: 255-264 (2019) Article DOI: 10.1016/j.bmc.2018.11.022 BindingDB Entry DOI: 10.7270/Q2F47SC4
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM108726 (US8604016, 1038 | US9938267, Cmpd ID 1038) Show SMILES O=C(Cc1ccccc1)Nc1ccc(CCCCc2ccc(NC(=O)Cc3ccccc3)nn2)nn1 Show InChI InChI=1S/C28H28N6O2/c35-27(19-21-9-3-1-4-10-21)29-25-17-15-23(31-33-25)13-7-8-14-24-16-18-26(34-32-24)30-28(36)20-22-11-5-2-6-12-22/h1-6,9-12,15-18H,7-8,13-14,19-20H2,(H,29,33,35)(H,30,34,36)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of GAC (unknown origin) assessed as NADH formation using 10 mM glutamine as substrate preincubated for 60 mins				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 [44-750] (Homo sapiens (Human))	BDBM17775 (3-(1-carboxy-4-sulfanylbutoxy)benzoic acid | Thiol...) Show SMILES OC(=O)C(CCCS)Oc1cccc(c1)C(O)=O Show InChI InChI=1S/C12H14O5S/c13-11(14)8-3-1-4-9(7-8)17-10(12(15)16)5-2-6-18/h1,3-4,7,10,18H,2,5-6H2,(H,13,14)(H,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	7.4	37
MGI Pharma					Assay Description GCPII activity in vitro is monitored through the hydrolysis [3H]NAAG to NAA and [3H]Glu. The radioactivity-based assay was miniaturized to a 96-well ...				J Med Chem 49: 2876-85 (2006) Article DOI: 10.1021/jm051019l BindingDB Entry DOI: 10.7270/Q28C9TJD
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM17762 (3-[2-carboxy-2-(3-sulfanylpropyl)ethyl]benzoic aci...) Show SMILES OC(=O)C(CCCS)Cc1cccc(c1)C(O)=O Show InChI InChI=1S/C13H16O4S/c14-12(15)10-4-1-3-9(7-10)8-11(13(16)17)5-2-6-18/h1,3-4,7,11,18H,2,5-6,8H2,(H,14,15)(H,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant GCP2 using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate by microplate assay				J Med Chem 55: 5922-32 (2012) Article DOI: 10.1021/jm300488m BindingDB Entry DOI: 10.7270/Q21J9BWN
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 [44-750] (Homo sapiens (Human))	BDBM17762 (3-[2-carboxy-2-(3-sulfanylpropyl)ethyl]benzoic aci...) Show SMILES OC(=O)C(CCCS)Cc1cccc(c1)C(O)=O Show InChI InChI=1S/C13H16O4S/c14-12(15)10-4-1-3-9(7-10)8-11(13(16)17)5-2-6-18/h1,3-4,7,11,18H,2,5-6,8H2,(H,14,15)(H,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	7.4	37
MGI Pharma					Assay Description GCPII activity in vitro is monitored through the hydrolysis [3H]NAAG to NAA and [3H]Glu. The radioactivity-based assay was miniaturized to a 96-well ...				J Med Chem 49: 2876-85 (2006) Article DOI: 10.1021/jm051019l BindingDB Entry DOI: 10.7270/Q28C9TJD
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50503754 (CHEMBL4458733) Show SMILES CC(C)C[C@@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C12H20N2O7/c1-6(2)5-8(11(19)20)14-12(21)13-7(10(17)18)3-4-9(15)16/h6-8H,3-5H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)(H2,13,14,21)/t7-,8+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Biotechnology of the Czech Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...				Bioorg Med Chem 27: 255-264 (2019) Article DOI: 10.1016/j.bmc.2018.11.022 BindingDB Entry DOI: 10.7270/Q2F47SC4
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50392041 (CHEMBL2152557) Show SMILES OC(=O)c1ccc(COc2ccc(CS)cc2C(O)=O)cc1 Show InChI InChI=1S/C16H14O5S/c17-15(18)12-4-1-10(2-5-12)8-21-14-6-3-11(9-22)7-13(14)16(19)20/h1-7,22H,8-9H2,(H,17,18)(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant GCP2 using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate by microplate assay				J Med Chem 55: 5922-32 (2012) Article DOI: 10.1021/jm300488m BindingDB Entry DOI: 10.7270/Q21J9BWN
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50503757 (CHEMBL4541841) Show SMILES CC(C)C[C@H](OC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C12H19NO8/c1-6(2)5-8(11(18)19)21-12(20)13-7(10(16)17)3-4-9(14)15/h6-8H,3-5H2,1-2H3,(H,13,20)(H,14,15)(H,16,17)(H,18,19)/t7-,8-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Biotechnology of the Czech Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of N-terminally tagged human recombinant GCP2 (44 to 750 residues) extracellular domain expressed in Drosophila melanogaster S2 cells prei...				Bioorg Med Chem 27: 255-264 (2019) Article DOI: 10.1016/j.bmc.2018.11.022 BindingDB Entry DOI: 10.7270/Q2F47SC4
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM278400 ((2S)-2-Methoxy-2-phenyl-N-[5-[[(3R)-1-pyridazin-3-...) Show SMILES CO[C@H](C(=O)Nc1nnc(N[C@@H]2CCN(C2)c2cccnn2)s1)c1ccccc1 |r| Show InChI InChI=1S/C19H21N7O2S/c1-28-16(13-6-3-2-4-7-13)17(27)22-19-25-24-18(29-19)21-14-9-11-26(12-14)15-8-5-10-20-23-15/h2-8,10,14,16H,9,11-12H2,1H3,(H,21,24)(H,22,25,27)/t14-,16+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human KGA (63 to 669 residues) preincubated for 15 mins using 50 mM glutamine as substrate by resorufin dye based assay				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50332228 (1-(3-Carboxyphenyl)-3-(2-mercapto-ethyl)-1H-indole...) Show SMILES OC(=O)c1c(CCS)c2ccccc2n1-c1cccc(c1)C(O)=O Show InChI InChI=1S/C18H15NO4S/c20-17(21)11-4-3-5-12(10-11)19-15-7-2-1-6-13(15)14(8-9-24)16(19)18(22)23/h1-7,10,24H,8-9H2,(H,20,21)(H,22,23)	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	22	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant GCP2 using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate by microplate assay				J Med Chem 55: 5922-32 (2012) Article DOI: 10.1021/jm300488m BindingDB Entry DOI: 10.7270/Q21J9BWN
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Mus musculus)	BDBM50503321 (CHEMBL4540444) Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2ccc(CC3CC(C3)c3nnc(NC(=O)Cc4ccccn4)s3)nn2)c1 |(59.77,-42.92,;58.44,-43.69,;58.44,-45.23,;59.76,-44.46,;57.1,-42.93,;55.77,-43.7,;55.78,-45.25,;54.44,-46.03,;53.11,-45.25,;53.11,-43.71,;51.78,-42.95,;50.44,-43.71,;50.44,-45.25,;49.11,-42.95,;47.77,-43.72,;47.77,-45.26,;46.44,-46.03,;45.12,-45.25,;43.78,-46.02,;42.44,-45.25,;40.96,-45.64,;40.57,-44.16,;42.05,-43.77,;39.24,-43.4,;38.76,-41.92,;37.22,-41.92,;36.74,-43.4,;35.4,-44.15,;34.07,-43.38,;34.08,-41.84,;32.73,-44.13,;31.4,-43.36,;31.42,-41.82,;30.1,-41.03,;28.75,-41.8,;28.75,-43.35,;30.07,-44.11,;37.99,-44.3,;45.11,-43.72,;46.43,-42.95,;54.44,-42.95,)| Show InChI InChI=1S/C27H24F3N7O3S/c28-27(29,30)40-21-6-3-4-16(13-21)14-23(38)32-22-8-7-20(34-35-22)12-17-10-18(11-17)25-36-37-26(41-25)33-24(39)15-19-5-1-2-9-31-19/h1-9,13,17-18H,10-12,14-15H2,(H,32,35,38)(H,33,37,39)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<25	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of mouse kidney glutaminase assessed as ammonia formation at 0.1 uM using glutamine as substrate by Nessler's reagent based assay relative...				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM332752 ((2S)-2-[3-(Difluoromethoxy)phenyl]-2-methoxy-N-[6-...) Show SMILES CO[C@H](C(=O)Nc1ccc(nn1)N1CC[C@H](C1)Nc1cccnn1)c1cccc(OC(F)F)c1 |r| Show InChI InChI=1S/C22H23F2N7O3/c1-33-20(14-4-2-5-16(12-14)34-22(23)24)21(32)27-18-7-8-19(30-29-18)31-11-9-15(13-31)26-17-6-3-10-25-28-17/h2-8,10,12,15,20,22H,9,11,13H2,1H3,(H,26,28)(H,27,29,32)/t15-,20+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human KGA (63 to 669 residues) preincubated for 15 mins using 50 mM glutamine as substrate by resorufin dye based assay				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50117761 (CHEMBL3613920 | US9505753, 5aa) Show SMILES Oc1nn(Cc2ccc3ccccc3c2)c(=O)[nH]c1=O Show InChI InChI=1S/C14H11N3O3/c18-12-13(19)16-17(14(20)15-12)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7H,8H2,(H,16,19)(H,15,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	8.5	25
THE JOHNS HOPKINS UNIVERSITY US Patent					Assay Description A reliable 96-well plate D-amino acid oxidase (DAAO) assay was developed based on previously published reports (J. Biol. Chem. 277: 27782 (2002)). Br...				US Patent US9505753 (2016) BindingDB Entry DOI: 10.7270/Q21J98QK
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM258332 (US9505753, 5y) Show SMILES Oc1nn(CCc2ccc(Cl)c(Cl)c2)c(=O)[nH]c1=O Show InChI InChI=1S/C11H9Cl2N3O3/c12-7-2-1-6(5-8(7)13)3-4-16-11(19)14-9(17)10(18)15-16/h1-2,5H,3-4H2,(H,15,18)(H,14,17,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	8.5	25
THE JOHNS HOPKINS UNIVERSITY US Patent					Assay Description A reliable 96-well plate D-amino acid oxidase (DAAO) assay was developed based on previously published reports (J. Biol. Chem. 277: 27782 (2002)). Br...				US Patent US9505753 (2016) BindingDB Entry DOI: 10.7270/Q21J98QK
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50117813 (CHEMBL3613946 | US9505753, 5o) Show SMILES Oc1nn(CCc2ccc(cc2)-c2ccccc2)c(=O)[nH]c1=O Show InChI InChI=1S/C17H15N3O3/c21-15-16(22)19-20(17(23)18-15)11-10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,19,22)(H,18,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	8.5	25
THE JOHNS HOPKINS UNIVERSITY US Patent					Assay Description A reliable 96-well plate D-amino acid oxidase (DAAO) assay was developed based on previously published reports (J. Biol. Chem. 277: 27782 (2002)). Br...				US Patent US9505753 (2016) BindingDB Entry DOI: 10.7270/Q21J98QK
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50117818 (CHEMBL3613929 | US9505753, 5e) Show SMILES Oc1nn(CCc2ccc(Cl)cc2)c(=O)[nH]c1=O Show InChI InChI=1S/C11H10ClN3O3/c12-8-3-1-7(2-4-8)5-6-15-11(18)13-9(16)10(17)14-15/h1-4H,5-6H2,(H,14,17)(H,13,16,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	8.5	25
THE JOHNS HOPKINS UNIVERSITY US Patent					Assay Description A reliable 96-well plate D-amino acid oxidase (DAAO) assay was developed based on previously published reports (J. Biol. Chem. 277: 27782 (2002)). Br...				US Patent US9505753 (2016) BindingDB Entry DOI: 10.7270/Q21J98QK
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM50547684 (CHEMBL4740067) Show SMILES O=C(Cc1ccccc1)Nc1nnc(SCCc2ccc(NC(=O)Cc3ccccc3)nn2)s1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of human kidney glutaminase using [3H]-Glutamine as substrate in presence of inhibitor incubated for 45 mins by Perkin Elmer ba...				Citation and Details Article DOI: 10.1016/j.bmc.2020.115698 BindingDB Entry DOI: 10.7270/Q2KW5KMV
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50160756 (CHEMBL3787162) Show SMILES Oc1nc(SCc2ccc(Cl)cc2)n[nH]c1=O Show InChI InChI=1S/C10H8ClN3O2S/c11-7-3-1-6(2-4-7)5-17-10-12-8(15)9(16)13-14-10/h1-4H,5H2,(H,13,16)(H,12,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Inhibition of recombinant human DAAO assessed as oxidative deamination of D-serine in presence of molecular oxygen and FAD after 20 mins				Bioorg Med Chem Lett 26: 2088-91 (2016) Article DOI: 10.1016/j.bmcl.2016.02.068 BindingDB Entry DOI: 10.7270/Q2RB76HR
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50160750 (CHEMBL3786955) Show SMILES Oc1nc(SCc2ccc3cc(F)ccc3c2)n[nH]c1=O Show InChI InChI=1S/C14H10FN3O2S/c15-11-4-3-9-5-8(1-2-10(9)6-11)7-21-14-16-12(19)13(20)17-18-14/h1-6H,7H2,(H,17,20)(H,16,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Inhibition of recombinant human DAAO assessed as oxidative deamination of D-serine in presence of molecular oxygen and FAD after 20 mins				Bioorg Med Chem Lett 26: 2088-91 (2016) Article DOI: 10.1016/j.bmcl.2016.02.068 BindingDB Entry DOI: 10.7270/Q2RB76HR
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 [44-750] (Homo sapiens (Human))	BDBM17776 (3-[(1-carboxy-4-sulfanylbutyl)sulfanyl]benzoic aci...) Show SMILES OC(=O)C(CCCS)Sc1cccc(c1)C(O)=O Show InChI InChI=1S/C12H14O4S2/c13-11(14)8-3-1-4-9(7-8)18-10(12(15)16)5-2-6-17/h1,3-4,7,10,17H,2,5-6H2,(H,13,14)(H,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	7.4	37
MGI Pharma					Assay Description GCPII activity in vitro is monitored through the hydrolysis [3H]NAAG to NAA and [3H]Glu. The radioactivity-based assay was miniaturized to a 96-well ...				J Med Chem 49: 2876-85 (2006) Article DOI: 10.1021/jm051019l BindingDB Entry DOI: 10.7270/Q28C9TJD
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50392036 (CHEMBL2152437) Show SMILES OC(=O)c1cccc(c1)-c1ccc(CS)cc1C(O)=O Show InChI InChI=1S/C15H12O4S/c16-14(17)11-3-1-2-10(7-11)12-5-4-9(8-20)6-13(12)15(18)19/h1-7,20H,8H2,(H,16,17)(H,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant GCP2 using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate by microplate assay				J Med Chem 55: 5922-32 (2012) Article DOI: 10.1021/jm300488m BindingDB Entry DOI: 10.7270/Q21J9BWN
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM258337 (US9505753, 10b) Show SMILES Oc1nn(CCc2ccc(F)c(F)c2)c(=O)[nH]c1=O Show InChI InChI=1S/C11H9F2N3O3/c12-7-2-1-6(5-8(7)13)3-4-16-11(19)14-9(17)10(18)15-16/h1-2,5H,3-4H2,(H,15,18)(H,14,17,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	40	n/a	n/a	n/a	n/a	8.5	25
THE JOHNS HOPKINS UNIVERSITY US Patent					Assay Description A reliable 96-well plate D-amino acid oxidase (DAAO) assay was developed based on previously published reports (J. Biol. Chem. 277: 27782 (2002)). Br...				US Patent US9505753 (2016) BindingDB Entry DOI: 10.7270/Q21J98QK
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50117818 (CHEMBL3613929 | US9505753, 5e) Show SMILES Oc1nn(CCc2ccc(Cl)cc2)c(=O)[nH]c1=O Show InChI InChI=1S/C11H10ClN3O3/c12-8-3-1-7(2-4-8)5-6-15-11(18)13-9(16)10(17)14-15/h1-4H,5-6H2,(H,14,17)(H,13,16,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Inhibition of recombinant human DAAO expressed in HEK cells using D-serine as substrate assessed as formation of alpha-keto acid, ammonia, hydrogen p...				J Med Chem 58: 7258-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b00482 BindingDB Entry DOI: 10.7270/Q2SF2XZQ
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM387025 ((2S)-N-[5-[[(3R)-1-(5-Chloropyridazin-3-yl)pyrroli...) Show SMILES CO[C@H](C(=O)Nc1nnc(N[C@@H]2CCN(C2)c2cc(Cl)cnn2)s1)c1ccccc1 |r| Show InChI InChI=1S/C19H20ClN7O2S/c1-29-16(12-5-3-2-4-6-12)17(28)23-19-26-25-18(30-19)22-14-7-8-27(11-14)15-9-13(20)10-21-24-15/h2-6,9-10,14,16H,7-8,11H2,1H3,(H,22,25)(H,23,26,28)/t14-,16+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human KGA (63 to 669 residues) preincubated for 15 mins using 50 mM glutamine as substrate by resorufin dye based assay				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM387008 ((2S)-N-[5-[[(3R)-1-(6-Fluoropyridazin-3-yl)pyrroli...) Show SMILES CO[C@H](C(=O)Nc1nnc(N[C@@H]2CCN(C2)c2ccc(F)nn2)s1)c1cccc(OC)c1 |r| Show InChI InChI=1S/C20H22FN7O3S/c1-30-14-5-3-4-12(10-14)17(31-2)18(29)23-20-27-26-19(32-20)22-13-8-9-28(11-13)16-7-6-15(21)24-25-16/h3-7,10,13,17H,8-9,11H2,1-2H3,(H,22,26)(H,23,27,29)/t13-,17+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human KGA (63 to 669 residues) preincubated for 15 mins using 50 mM glutamine as substrate by resorufin dye based assay				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutamate carboxypeptidase 2 (Homo sapiens (Human))	BDBM50392039 (CHEMBL2152555) Show SMILES OC(=O)c1ccccc1COc1ccc(CS)cc1C(O)=O Show InChI InChI=1S/C16H14O5S/c17-15(18)12-4-2-1-3-11(12)8-21-14-6-5-10(9-22)7-13(14)16(19)20/h1-7,22H,8-9H2,(H,17,18)(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant GCP2 using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate by microplate assay				J Med Chem 55: 5922-32 (2012) Article DOI: 10.1021/jm300488m BindingDB Entry DOI: 10.7270/Q21J9BWN
					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50117763 (CHEMBL3613921 | US9505753, 5u) Show SMILES Oc1nn(Cc2cccc3ccccc23)c(=O)[nH]c1=O Show InChI InChI=1S/C14H11N3O3/c18-12-13(19)16-17(14(20)15-12)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,16,19)(H,15,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	50	n/a	n/a	n/a	n/a	8.5	25
THE JOHNS HOPKINS UNIVERSITY US Patent					Assay Description A reliable 96-well plate D-amino acid oxidase (DAAO) assay was developed based on previously published reports (J. Biol. Chem. 277: 27782 (2002)). Br...				US Patent US9505753 (2016) BindingDB Entry DOI: 10.7270/Q21J98QK
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM109086 (US10793535, Cmpd ID 727 | US8604016, 670 | US99382...) Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)nn2)c1 Show InChI InChI=1S/C26H24F3N7O3S/c27-26(28,29)39-20-9-5-6-17(14-20)15-22(37)31-21-12-11-18(33-34-21)7-1-2-10-24-35-36-25(40-24)32-23(38)16-19-8-3-4-13-30-19/h3-6,8-9,11-14H,1-2,7,10,15-16H2,(H,31,34,37)(H,32,36,38)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of human kidney glutaminase using [3H]-Glutamine as substrate in presence of inhibitor incubated for 45 mins by Perkin Elmer ba...				Citation and Details Article DOI: 10.1016/j.bmc.2020.115698 BindingDB Entry DOI: 10.7270/Q2KW5KMV
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutaminase kidney isoform, mitochondrial (Homo sapiens (Human))	BDBM50547673 (CHEMBL4786465) Show SMILES O=C(Cc1ccccc1)Nc1nnc(CCSc2nnc(NC(=O)Cc3ccccc3)s2)s1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Allosteric inhibition of human kidney glutaminase using [3H]-Glutamine as substrate in presence of inhibitor incubated for 45 mins by Perkin Elmer ba...				Citation and Details Article DOI: 10.1016/j.bmc.2020.115698 BindingDB Entry DOI: 10.7270/Q2KW5KMV
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Mus musculus)	BDBM50503289 (CHEMBL4462220) Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2ccc(nn2)N2CCCC(C2)c2nnc(NC(=O)Cc3ccccn3)s2)c1 Show InChI InChI=1S/C27H25F3N8O3S/c28-27(29,30)41-20-8-3-5-17(13-20)14-23(39)32-21-9-10-22(35-34-21)38-12-4-6-18(16-38)25-36-37-26(42-25)33-24(40)15-19-7-1-2-11-31-19/h1-3,5,7-11,13,18H,4,6,12,14-16H2,(H,32,34,39)(H,33,37,40)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of mouse kidney glutaminase assessed as ammonia formation at 0.1 uM using glutamine as substrate by Nessler's reagent based assay relative...				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Mus musculus)	BDBM50503291 (CHEMBL4562029) Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2ccc(CCCCc3nnc(NC(=O)Cc4ccccn4)s3)cn2)c1 Show InChI InChI=1S/C27H25F3N6O3S/c28-27(29,30)39-21-9-5-7-19(14-21)15-23(37)33-22-12-11-18(17-32-22)6-1-2-10-25-35-36-26(40-25)34-24(38)16-20-8-3-4-13-31-20/h3-5,7-9,11-14,17H,1-2,6,10,15-16H2,(H,32,33,37)(H,34,36,38)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of mouse kidney glutaminase assessed as ammonia formation using glutamine as substrate by Nessler's reagent based assay				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial (Mus musculus)	BDBM50503294 (CHEMBL4577734) Show SMILES FC(F)(F)Oc1cccc(CC(=O)Nc2nnc(s2)C2CCN(CC2)c2ccc(NC(=O)Cc3ccccn3)nn2)c1 Show InChI InChI=1S/C27H25F3N8O3S/c28-27(29,30)41-20-6-3-4-17(14-20)15-23(39)33-26-37-36-25(42-26)18-9-12-38(13-10-18)22-8-7-21(34-35-22)32-24(40)16-19-5-1-2-11-31-19/h1-8,11,14,18H,9-10,12-13,15-16H2,(H,32,34,40)(H,33,37,39)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of mouse kidney glutaminase assessed as ammonia formation at 0.1 uM using glutamine as substrate by Nessler's reagent based assay relative...				J Med Chem 62: 46-59 (2019) Article DOI: 10.1021/acs.jmedchem.8b00327 BindingDB Entry DOI: 10.7270/Q26T0QZ0
					More data for this Ligand-Target Pair

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