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Compile Data Set for Download or QSAR

Found 30 hits with Last Name = 'flanary' and Initial = 'jm'   
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
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17659
PNG
((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)
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0.200n/an/an/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Concentration of the compound required for the neuroprotective effect determined by inhibition of GCP II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bacterial leucyl aminopeptidase


(Vibrio proteolyticus)
BDBM50129200
PNG
((R)-2-Amino-4-methyl-pentanoic acid hydroxyamide |...)
Show SMILES CC(C)C[C@@H](N)C(=O)NO
Show InChI InChI=1S/C6H14N2O2/c1-4(2)3-5(7)6(9)8-10/h4-5,10H,3,7H2,1-2H3,(H,8,9)/t5-/m1/s1
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2n/an/an/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of metalloprotease from family M28, Aeromonas proteolytica aminopeptidase


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Bacterial leucyl aminopeptidase


(Vibrio proteolyticus)
BDBM50129202
PNG
((S)-2-Amino-4-methyl-pentanoic acid hydroxyamide |...)
Show SMILES CC(C)C[C@H](N)C(=O)NO
Show InChI InChI=1S/C6H14N2O2/c1-4(2)3-5(7)6(9)8-10/h4-5,10H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1
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350n/an/an/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of metalloprotease from family M28, Aeromonas proteolytica aminopeptidase


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17659
PNG
((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)
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n/an/a 0.300n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50116251
PNG
(2-{[3-(4-Amino-benzoylamino)-3-carboxy-propyl]-hyd...)
Show SMILES Nc1ccc(cc1)C(=O)N[C@@H](CCP(O)(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C16H21N2O10P/c17-10-3-1-9(2-4-10)14(21)18-11(15(22)23)7-8-29(26,27)28-12(16(24)25)5-6-13(19)20/h1-4,11-12H,5-8,17H2,(H,18,21)(H,19,20)(H,22,23)(H,24,25)(H,26,27)/t11-,12-/m0/s1
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n/an/a 3n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit Glutamate carboxypeptidase-II using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate


Bioorg Med Chem Lett 12: 2189-92 (2002)


BindingDB Entry DOI: 10.7270/Q21835TN
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50116253
PNG
(2-{[3-Carboxy-3-(4-methylamino-benzoylamino)-propy...)
Show SMILES CNc1ccc(cc1)C(=O)N[C@@H](CCP(O)(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C17H23N2O10P/c1-18-11-4-2-10(3-5-11)15(22)19-12(16(23)24)8-9-30(27,28)29-13(17(25)26)6-7-14(20)21/h2-5,12-13,18H,6-9H2,1H3,(H,19,22)(H,20,21)(H,23,24)(H,25,26)(H,27,28)/t12-,13-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit Glutamate carboxypeptidase-II using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate


Bioorg Med Chem Lett 12: 2189-92 (2002)


BindingDB Entry DOI: 10.7270/Q21835TN
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50116250
PNG
(2-[(3-Carboxy-3-{4-[(2,4-diamino-pteridin-6-ylmeth...)
Show SMILES CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCP(O)(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C24H29N8O10P/c1-32(11-13-10-27-20-18(28-13)19(25)30-24(26)31-20)14-4-2-12(3-5-14)21(35)29-15(22(36)37)8-9-43(40,41)42-16(23(38)39)6-7-17(33)34/h2-5,10,15-16H,6-9,11H2,1H3,(H,29,35)(H,33,34)(H,36,37)(H,38,39)(H,40,41)(H4,25,26,27,30,31)/t15-,16-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit Glutamate carboxypeptidase-II using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate


Bioorg Med Chem Lett 12: 2189-92 (2002)


BindingDB Entry DOI: 10.7270/Q21835TN
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50116252
PNG
(2-[(3-Carboxy-3-{4-[(2,4-diamino-pteridin-6-ylmeth...)
Show SMILES CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCP(O)(=O)OC(CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C24H29N8O10P/c1-32(11-13-10-27-20-18(28-13)19(25)30-24(26)31-20)14-4-2-12(3-5-14)21(35)29-15(22(36)37)8-9-43(40,41)42-16(23(38)39)6-7-17(33)34/h2-5,10,15-16H,6-9,11H2,1H3,(H,29,35)(H,33,34)(H,36,37)(H,38,39)(H,40,41)(H4,25,26,27,30,31)
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n/an/a 5n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit Glutamate carboxypeptidase-II using N-acetyl-L-aspartyl-[3H]-L-glutamate as substrate


Bioorg Med Chem Lett 12: 2189-92 (2002)


BindingDB Entry DOI: 10.7270/Q21835TN
More data for this
Ligand-Target Pair
Folylpolyglutamate synthase, mitochondrial


(Homo sapiens (Human))
BDBM50116252
PNG
(2-[(3-Carboxy-3-{4-[(2,4-diamino-pteridin-6-ylmeth...)
Show SMILES CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCP(O)(=O)OC(CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C24H29N8O10P/c1-32(11-13-10-27-20-18(28-13)19(25)30-24(26)31-20)14-4-2-12(3-5-14)21(35)29-15(22(36)37)8-9-43(40,41)42-16(23(38)39)6-7-17(33)34/h2-5,10,15-16H,6-9,11H2,1H3,(H,29,35)(H,33,34)(H,36,37)(H,38,39)(H,40,41)(H4,25,26,27,30,31)
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n/an/a 20n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit Folylpoly-gamma-glutamyl synthetase


Bioorg Med Chem Lett 12: 2189-92 (2002)


BindingDB Entry DOI: 10.7270/Q21835TN
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17752
PNG
(2-({hydroxy[(2,3,4,5,6-pentafluorophenyl)methyl]ph...)
Show SMILES OC(=O)CCC(CP(O)(=O)Cc1c(F)c(F)c(F)c(F)c1F)C(O)=O
Show InChI InChI=1S/C13H12F5O6P/c14-8-6(9(15)11(17)12(18)10(8)16)4-25(23,24)3-5(13(21)22)1-2-7(19)20/h5H,1-4H2,(H,19,20)(H,21,22)(H,23,24)
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n/an/a 82n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17755
PNG
(2-(3-sulfanylpropyl)pentanedioic acid | 2-MPPA | C...)
Show SMILES OC(=O)CCC(CCCS)C(O)=O
Show InChI InChI=1S/C8H14O4S/c9-7(10)4-3-6(8(11)12)2-1-5-13/h6,13H,1-5H2,(H,9,10)(H,11,12)
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n/an/a 90n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Folylpolyglutamate synthase, mitochondrial


(Homo sapiens (Human))
BDBM50116250
PNG
(2-[(3-Carboxy-3-{4-[(2,4-diamino-pteridin-6-ylmeth...)
Show SMILES CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCP(O)(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C24H29N8O10P/c1-32(11-13-10-27-20-18(28-13)19(25)30-24(26)31-20)14-4-2-12(3-5-14)21(35)29-15(22(36)37)8-9-43(40,41)42-16(23(38)39)6-7-17(33)34/h2-5,10,15-16H,6-9,11H2,1H3,(H,29,35)(H,33,34)(H,36,37)(H,38,39)(H,40,41)(H4,25,26,27,30,31)/t15-,16-/m0/s1
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n/an/a 120n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit Folylpoly-gamma-glutamyl synthetase


Bioorg Med Chem Lett 12: 2189-92 (2002)


BindingDB Entry DOI: 10.7270/Q21835TN
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17779
PNG
(2-[(hydroxycarbamoyl)methyl]pentanedioic acid | CH...)
Show SMILES ONC(=O)CC(CCC(O)=O)C(O)=O
Show InChI InChI=1S/C7H11NO6/c9-5(8-14)3-4(7(12)13)1-2-6(10)11/h4,14H,1-3H2,(H,8,9)(H,10,11)(H,12,13)
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n/an/a 220n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129199
PNG
(2-(3-Hydroxycarbamoyl-propyl)-pentanedioic acid | ...)
Show SMILES ONC(=O)CCCC(CCC(O)=O)C(O)=O
Show InChI InChI=1S/C9H15NO6/c11-7(10-16)3-1-2-6(9(14)15)4-5-8(12)13/h6,16H,1-5H2,(H,10,11)(H,12,13)(H,14,15)
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n/an/a 940n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129195
PNG
(2-(2-Hydroxycarbamoyl-ethyl)-pentanedioic acid | C...)
Show SMILES ONC(=O)CCC(CCC(O)=O)C(O)=O
Show InChI InChI=1S/C8H13NO6/c10-6(9-15)3-1-5(8(13)14)2-4-7(11)12/h5,15H,1-4H2,(H,9,10)(H,11,12)(H,13,14)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129193
PNG
(2-Hydroxycarbamoyl-pentanedioic acid | CHEMBL43272...)
Show SMILES ONC(=O)C(CCC(O)=O)C(O)=O
Show InChI InChI=1S/C6H9NO6/c8-4(9)2-1-3(6(11)12)5(10)7-13/h3,13H,1-2H2,(H,7,10)(H,8,9)(H,11,12)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Folylpolyglutamate synthase, mitochondrial


(Homo sapiens (Human))
BDBM50116253
PNG
(2-{[3-Carboxy-3-(4-methylamino-benzoylamino)-propy...)
Show SMILES CNc1ccc(cc1)C(=O)N[C@@H](CCP(O)(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C17H23N2O10P/c1-18-11-4-2-10(3-5-11)15(22)19-12(16(23)24)8-9-30(27,28)29-13(17(25)26)6-7-14(20)21/h2-5,12-13,18H,6-9H2,1H3,(H,19,22)(H,20,21)(H,23,24)(H,25,26)(H,27,28)/t12-,13-/m0/s1
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n/an/a 5.70E+3n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit Folylpoly-gamma-glutamyl synthetase


Bioorg Med Chem Lett 12: 2189-92 (2002)


BindingDB Entry DOI: 10.7270/Q21835TN
More data for this
Ligand-Target Pair
Folylpolyglutamate synthase, mitochondrial


(Homo sapiens (Human))
BDBM50116251
PNG
(2-{[3-(4-Amino-benzoylamino)-3-carboxy-propyl]-hyd...)
Show SMILES Nc1ccc(cc1)C(=O)N[C@@H](CCP(O)(=O)O[C@@H](CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C16H21N2O10P/c17-10-3-1-9(2-4-10)14(21)18-11(15(22)23)7-8-29(26,27)28-12(16(24)25)5-6-13(19)20/h1-4,11-12H,5-8,17H2,(H,18,21)(H,19,20)(H,22,23)(H,24,25)(H,26,27)/t11-,12-/m0/s1
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n/an/a 8.60E+3n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to inhibit Folylpoly-gamma-glutamyl synthetase


Bioorg Med Chem Lett 12: 2189-92 (2002)


BindingDB Entry DOI: 10.7270/Q21835TN
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17781
PNG
(CHEMBL65860 | butane-1,2,4-tricarboxylic acid | ca...)
Show SMILES OC(=O)CCC(CC(O)=O)C(O)=O
Show InChI InChI=1S/C7H10O6/c8-5(9)2-1-4(7(12)13)3-6(10)11/h4H,1-3H2,(H,8,9)(H,10,11)(H,12,13)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129197
PNG
(4-(Hydroxyamino)-4-oxobutanoic acid | CHEMBL51979 ...)
Show SMILES ONC(=O)CCC(O)=O
Show InChI InChI=1S/C4H7NO4/c6-3(5-9)1-2-4(7)8/h9H,1-2H2,(H,5,6)(H,7,8)
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n/an/a 4.30E+4n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129196
PNG
((S)-2-Amino-4-hydroxycarbamoyl-butyric acid | (S)-...)
Show SMILES N[C@@H](CCC(=O)NO)C(O)=O
Show InChI InChI=1S/C5H10N2O4/c6-3(5(9)10)1-2-4(8)7-11/h3,11H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129203
PNG
((R)-3-Acetylamino-N-hydroxy-succinamic acid | CHEM...)
Show SMILES CC(=O)N[C@H](CC(O)=O)C(=O)NO
Show InChI InChI=1S/C6H10N2O5/c1-3(9)7-4(2-5(10)11)6(12)8-13/h4,13H,2H2,1H3,(H,7,9)(H,8,12)(H,10,11)/t4-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129194
PNG
((2S)-2-amino-4-(hydroxyamino)-4-oxobutanoic acidN(...)
Show SMILES N[C@@H](CC(=O)NO)C(O)=O
Show InChI InChI=1S/C4H8N2O4/c5-2(4(8)9)1-3(7)6-10/h2,10H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129201
PNG
((S)-3-Acetylamino-N-hydroxy-succinamic acid | CHEM...)
Show SMILES CC(=O)N[C@@H](CC(O)=O)C(=O)NO
Show InChI InChI=1S/C6H10N2O5/c1-3(9)7-4(2-5(10)11)6(12)8-13/h4,13H,2H2,1H3,(H,7,9)(H,8,12)(H,10,11)/t4-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129198
PNG
((R)-2-Amino-N-hydroxy-succinamic acid | CHEMBL4139...)
Show SMILES N[C@H](CC(=O)NO)C(O)=O
Show InChI InChI=1S/C4H8N2O4/c5-2(4(8)9)1-3(7)6-10/h2,10H,1,5H2,(H,6,7)(H,8,9)/t2-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17755
PNG
(2-(3-sulfanylpropyl)pentanedioic acid | 2-MPPA | C...)
Show SMILES OC(=O)CCC(CCCS)C(O)=O
Show InChI InChI=1S/C8H14O4S/c9-7(10)4-3-6(8(11)12)2-1-5-13/h6,13H,1-5H2,(H,9,10)(H,11,12)
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n/an/an/an/a 13n/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Concentration of the compound required for the neuroprotective effect determined by inhibition of GCP II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17659
PNG
((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)
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PubMed
n/an/an/an/a 0.620n/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Concentration of the compound required for the neuroprotective effect determined by inhibition of GCP II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17779
PNG
(2-[(hydroxycarbamoyl)methyl]pentanedioic acid | CH...)
Show SMILES ONC(=O)CC(CCC(O)=O)C(O)=O
Show InChI InChI=1S/C7H11NO6/c9-5(8-14)3-4(7(12)13)1-2-6(10)11/h4,14H,1-3H2,(H,8,9)(H,10,11)(H,12,13)
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n/an/an/an/a 220n/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Concentration of the compound required for the neuroprotective effect determined by inhibition of GCP II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM17752
PNG
(2-({hydroxy[(2,3,4,5,6-pentafluorophenyl)methyl]ph...)
Show SMILES OC(=O)CCC(CP(O)(=O)Cc1c(F)c(F)c(F)c(F)c1F)C(O)=O
Show InChI InChI=1S/C13H12F5O6P/c14-8-6(9(15)11(17)12(18)10(8)16)4-25(23,24)3-5(13(21)22)1-2-7(19)20/h5H,1-4H2,(H,19,20)(H,21,22)(H,23,24)
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n/an/an/an/a 9.5n/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration required against Glutamate carboxypeptidase II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50129199
PNG
(2-(3-Hydroxycarbamoyl-propyl)-pentanedioic acid | ...)
Show SMILES ONC(=O)CCCC(CCC(O)=O)C(O)=O
Show InChI InChI=1S/C9H15NO6/c11-7(10-16)3-1-2-6(9(14)15)4-5-8(12)13/h6,16H,1-5H2,(H,10,11)(H,12,13)(H,14,15)
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n/an/an/an/a 1.10E+3n/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Concentration of the compound required for the neuroprotective effect determined by inhibition of GCP II


Bioorg Med Chem Lett 13: 2097-100 (2003)


BindingDB Entry DOI: 10.7270/Q2Z60NF2
More data for this
Ligand-Target Pair