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Compile Data Set for Download or QSAR

Found 114 hits with Last Name = 'stoermer' and Initial = 'd'   
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
In vitro inhibitory activity against glutamate carboxypeptidase II (GCP II) using N-acetyl-L-aspartyl-[3H]-L-glutamate as a substrate


J Med Chem 46: 1989-96 (2003)


Article DOI: 10.1021/jm020515w
BindingDB Entry DOI: 10.7270/Q2SQ8ZRG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50109593
PNG
(2-Benzyl-3-mercapto-propionic acid | 2-Mercaptomet...)
Show SMILES OC(=O)C(CS)Cc1ccccc1
Show InChI InChI=1S/C10H12O2S/c11-10(12)9(7-13)6-8-4-2-1-3-5-8/h1-5,9,13H,6-7H2,(H,11,12)
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11n/an/an/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against glutamate carboxypeptidase II (GCP II) using N-acetyl-L-aspartyl-[3H]-L-glutamate as a substrate


J Med Chem 46: 1989-96 (2003)


Article DOI: 10.1021/jm020515w
BindingDB Entry DOI: 10.7270/Q2SQ8ZRG
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


(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 N-acetyl-L-aspartyl-[3H]-L-glutamate binding to glutamate carboxypeptidase II (GCP II)


J Med Chem 46: 1989-96 (2003)


Article DOI: 10.1021/jm020515w
BindingDB Entry DOI: 10.7270/Q2SQ8ZRG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate carboxypeptidase 2


(Rattus norvegicus)
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
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glutamate carboxypeptidase 2 [44-750]


(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/a7.437



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
3D Structure (crystal)
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50085699
PNG
((S,S / R,R)4-Carboxy-5-[(2,4-dicarboxy-butyl)-hydr...)
Show SMILES OC(=O)CCC(CP(O)(=O)CC(CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C12H19O10P/c13-9(14)3-1-7(11(17)18)5-23(21,22)6-8(12(19)20)2-4-10(15)16/h7-8H,1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20)(H,21,22)
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n/an/a 0.5n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50106576
PNG
(2-[(2-Carboxy-propyl)-hydroxy-phosphinoylmethyl]-p...)
Show SMILES CC(CP(O)(=O)CC(CCC(O)=O)C(O)=O)C(O)=O
Show InChI InChI=1S/C10H17O8P/c1-6(9(13)14)4-19(17,18)5-7(10(15)16)2-3-8(11)12/h6-7H,2-5H2,1H3,(H,11,12)(H,13,14)(H,15,16)(H,17,18)
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n/an/a 1.5n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50392045
PNG
(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)
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n/an/a 2n/an/an/an/an/an/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
PNG
(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)
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n/an/a 2n/an/an/an/an/an/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


(Rattus norvegicus)
BDBM50106577
PNG
(2-[(2-Carboxy-3-phenyl-propyl)-hydroxy-phosphinoyl...)
Show SMILES OC(=O)CCC(CP(O)(=O)CC(Cc1ccccc1)C(O)=O)C(O)=O
Show InChI InChI=1S/C16H21O8P/c17-14(18)7-6-12(15(19)20)9-25(23,24)10-13(16(21)22)8-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)
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n/an/a 2n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50106570
PNG
(2-{Hydroxy-[(4-methoxy-phenylamino)-methyl]-phosph...)
Show SMILES COc1ccc(NCP(O)(=O)CC(CCC(O)=O)C(O)=O)cc1
Show InChI InChI=1S/C14H20NO7P/c1-22-12-5-3-11(4-6-12)15-9-23(20,21)8-10(14(18)19)2-7-13(16)17/h3-6,10,15H,2,7-9H2,1H3,(H,16,17)(H,18,19)(H,20,21)
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n/an/a 3n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50106566
PNG
(2-(Hydroxy-phenylaminomethyl-phosphinoylmethyl)-pe...)
Show SMILES OC(=O)CCC(CP(O)(=O)CNc1ccccc1)C(O)=O
Show InChI InChI=1S/C13H18NO6P/c15-12(16)7-6-10(13(17)18)8-21(19,20)9-14-11-4-2-1-3-5-11/h1-5,10,14H,6-9H2,(H,15,16)(H,17,18)(H,19,20)
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n/an/a 4n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50392046
PNG
(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)
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n/an/a 7n/an/an/an/an/an/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


(Rattus norvegicus)
BDBM50106575
PNG
(2-[Hydroxy-(hydroxy-pyridin-4-yl-methyl)-phosphino...)
Show SMILES OC(=O)CCC(CP(O)(O)C(=O)c1ccncc1)C(O)=O
Show InChI InChI=1S/C12H16NO7P/c14-10(15)2-1-9(11(16)17)7-21(19,20)12(18)8-3-5-13-6-4-8/h3-6,9,19-21H,1-2,7H2,(H,14,15)(H,16,17)
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n/an/a 10n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2 [44-750]


(Homo sapiens (Human))
BDBM17775
PNG
(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)
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n/an/a 14n/an/an/an/a7.437



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 [44-750]


(Homo sapiens (Human))
BDBM17762
PNG
(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)
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n/an/a 15n/an/an/an/a7.437



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
PNG
(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)
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n/an/a 15n/an/an/an/an/an/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))
BDBM50392041
PNG
(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)
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n/an/a 16n/an/an/an/an/an/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


(Rattus norvegicus)
BDBM50106567
PNG
(2-{[(3-Fluoro-phenyl)-hydroxy-methyl]-hydroxy-phos...)
Show SMILES OC(=O)CCC(CP(O)(O)C(=O)c1cccc(F)c1)C(O)=O
Show InChI InChI=1S/C13H16FO7P/c14-10-3-1-2-8(6-10)13(19)22(20,21)7-9(12(17)18)4-5-11(15)16/h1-3,6,9,20-22H,4-5,7H2,(H,15,16)(H,17,18)
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n/an/a 16n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50332228
PNG
(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)
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n/an/a 22n/an/an/an/an/an/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))
BDBM17776
PNG
(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)
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n/an/a 32n/an/an/an/a7.437



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
PNG
(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)
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n/an/a 38n/an/an/an/an/an/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))
BDBM50392039
PNG
(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)
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n/an/a 41n/an/an/an/an/an/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


(Rattus norvegicus)
BDBM50106564
PNG
(2-[(3,5-Difluoro-benzyl)-hydroxy-phosphinoylmethyl...)
Show SMILES OC(=O)CCC(CP(O)(=O)Cc1cc(F)cc(F)c1)C(O)=O
Show InChI InChI=1S/C13H15F2O6P/c14-10-3-8(4-11(15)5-10)6-22(20,21)7-9(13(18)19)1-2-12(16)17/h3-5,9H,1-2,6-7H2,(H,16,17)(H,18,19)(H,20,21)
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n/an/a 49n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50392037
PNG
(CHEMBL2152438)
Show SMILES OC(=O)c1ccc(cc1)-c1ccc(CS)cc1C(O)=O
Show InChI InChI=1S/C15H12O4S/c16-14(17)11-4-2-10(3-5-11)12-6-1-9(8-20)7-13(12)15(18)19/h1-7,20H,8H2,(H,16,17)(H,18,19)
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n/an/a 52n/an/an/an/an/an/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


(Rattus norvegicus)
BDBM50106568
PNG
(2-(Benzyl-hydroxy-phosphinoylmethyl)-pentanedioic ...)
Show SMILES OC(=O)CCC(CP(O)(=O)Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C13H17O6P/c14-12(15)7-6-11(13(16)17)9-20(18,19)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,14,15)(H,16,17)(H,18,19)
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Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50106557
PNG
(2-[Hydroxy-(hydroxy-phenyl-methyl)-phosphinoylmeth...)
Show SMILES OC(=O)CCC(CP(O)(O)C(=O)c1ccccc1)C(O)=O
Show InChI InChI=1S/C13H17O7P/c14-11(15)7-6-10(12(16)17)8-21(19,20)13(18)9-4-2-1-3-5-9/h1-5,10,19-21H,6-8H2,(H,14,15)(H,16,17)
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n/an/a 55n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50106560
PNG
(2-[(3,5-Bis-trifluoromethyl-benzyl)-hydroxy-phosph...)
Show SMILES OC(=O)CCC(CP(O)(=O)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(O)=O
Show InChI InChI=1S/C15H15F6O6P/c16-14(17,18)10-3-8(4-11(5-10)15(19,20)21)6-28(26,27)7-9(13(24)25)1-2-12(22)23/h3-5,9H,1-2,6-7H2,(H,22,23)(H,24,25)(H,26,27)
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n/an/a 55n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50106571
PNG
(2-[(Benzylamino-methyl)-hydroxy-phosphinoylmethyl]...)
Show SMILES OC(=O)CCC(CP(O)(O)C=NCc1ccccc1)C(O)=O |w:11.11|
Show InChI InChI=1S/C14H20NO6P/c16-13(17)7-6-12(14(18)19)9-22(20,21)10-15-8-11-4-2-1-3-5-11/h1-5,10,12,20-22H,6-9H2,(H,16,17)(H,18,19)
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n/an/a 59n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2 [44-750]


(Homo sapiens (Human))
BDBM17763
PNG
(4-[2-carboxy-2-(3-sulfanylpropyl)ethyl]benzoic aci...)
Show SMILES OC(=O)C(CCCS)Cc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C13H16O4S/c14-12(15)10-5-3-9(4-6-10)8-11(13(16)17)2-1-7-18/h3-6,11,18H,1-2,7-8H2,(H,14,15)(H,16,17)
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n/an/a 63n/an/an/an/a7.437



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


(Rattus norvegicus)
BDBM50106555
PNG
(2-[Hydroxy-(4-methyl-benzyl)-phosphinoylmethyl]-pe...)
Show SMILES Cc1ccc(CP(O)(=O)CC(CCC(O)=O)C(O)=O)cc1
Show InChI InChI=1S/C14H19O6P/c1-10-2-4-11(5-3-10)8-21(19,20)9-12(14(17)18)6-7-13(15)16/h2-5,12H,6-9H2,1H3,(H,15,16)(H,17,18)(H,19,20)
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n/an/a 68n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50392049
PNG
(CHEMBL2152565)
Show SMILES OC(=O)c1cccc(COc2cccc(CCS)c2C(O)=O)c1
Show InChI InChI=1S/C17H16O5S/c18-16(19)13-5-1-3-11(9-13)10-22-14-6-2-4-12(7-8-23)15(14)17(20)21/h1-6,9,23H,7-8,10H2,(H,18,19)(H,20,21)
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n/an/a 69n/an/an/an/an/an/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))
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 [44-750]


(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/a7.437



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


(Rattus norvegicus)
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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Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
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 N-acetyl-L-aspartyl-[3H]-L-glutamate binding to glutamate carboxypeptidase II (GCP II)


J Med Chem 46: 1989-96 (2003)


Article DOI: 10.1021/jm020515w
BindingDB Entry DOI: 10.7270/Q2SQ8ZRG
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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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


(Rattus norvegicus)
BDBM50106572
PNG
(2-[Hydroxy-(4-methoxy-benzyl)-phosphinoylmethyl]-p...)
Show SMILES COc1ccc(CP(O)(=O)CC(CCC(O)=O)C(O)=O)cc1
Show InChI InChI=1S/C14H19O7P/c1-21-12-5-2-10(3-6-12)8-22(19,20)9-11(14(17)18)4-7-13(15)16/h2-3,5-6,11H,4,7-9H2,1H3,(H,15,16)(H,17,18)(H,19,20)
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Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
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
Glutamate carboxypeptidase 2 [44-750]


(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/a7.437



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


(Rattus norvegicus)
BDBM50106558
PNG
(2-[(2-Benzyloxycarbonyl-propyl)-hydroxy-phosphinoy...)
Show SMILES CC(CP(O)(=O)CC(CCC(O)=O)C(O)=O)C(=O)OCc1ccccc1
Show InChI InChI=1S/C17H23O8P/c1-12(17(22)25-9-13-5-3-2-4-6-13)10-26(23,24)11-14(16(20)21)7-8-15(18)19/h2-6,12,14H,7-11H2,1H3,(H,18,19)(H,20,21)(H,23,24)
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n/an/a 95n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2 [44-750]


(Homo sapiens (Human))
BDBM17777
PNG
(3-[2-carboxy-2-(phosphonomethyl)ethyl]benzoic acid...)
Show SMILES OC(=O)C(Cc1cccc(c1)C(O)=O)CP(O)(O)=O
Show InChI InChI=1S/C11H13O7P/c12-10(13)8-3-1-2-7(4-8)5-9(11(14)15)6-19(16,17)18/h1-4,9H,5-6H2,(H,12,13)(H,14,15)(H2,16,17,18)
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n/an/a 120n/an/an/an/a7.437



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))
BDBM50392048
PNG
(CHEMBL2152564)
Show SMILES OC(=O)c1ccccc1COc1cccc(CCS)c1C(O)=O
Show InChI InChI=1S/C17H16O5S/c18-16(19)13-6-2-1-4-12(13)10-22-14-7-3-5-11(8-9-23)15(14)17(20)21/h1-7,23H,8-10H2,(H,18,19)(H,20,21)
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n/an/a 140n/an/an/an/an/an/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


(Rattus norvegicus)
BDBM50106563
PNG
(2-[(3-Amino-benzyl)-hydroxy-phosphinoylmethyl]-pen...)
Show SMILES Nc1cccc(CP(O)(=O)CC(CCC(O)=O)C(O)=O)c1
Show InChI InChI=1S/C13H18NO6P/c14-11-3-1-2-9(6-11)7-21(19,20)8-10(13(17)18)4-5-12(15)16/h1-3,6,10H,4-5,7-8,14H2,(H,15,16)(H,17,18)(H,19,20)
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n/an/a 143n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50106578
PNG
(2-(Hydroxy-phenethyl-phosphinoylmethyl)-pentanedio...)
Show SMILES OC(=O)CCC(CP(O)(=O)CCc1ccccc1)C(O)=O
Show InChI InChI=1S/C14H19O6P/c15-13(16)7-6-12(14(17)18)10-21(19,20)9-8-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H,15,16)(H,17,18)(H,19,20)
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n/an/a 149n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
Glutamate carboxypeptidase 2


(Rattus norvegicus)
BDBM50106565
PNG
(2-[(2-Fluoro-benzyl)-hydroxy-phosphinoylmethyl]-pe...)
Show SMILES OC(=O)CCC(CP(O)(=O)Cc1ccccc1F)C(O)=O
Show InChI InChI=1S/C13H16FO6P/c14-11-4-2-1-3-9(11)7-21(19,20)8-10(13(17)18)5-6-12(15)16/h1-4,10H,5-8H2,(H,15,16)(H,17,18)(H,19,20)
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n/an/a 156n/an/an/an/an/an/a



Guilford Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain NAALADase (Folate hydrolase)


J Med Chem 44: 4170-5 (2001)


BindingDB Entry DOI: 10.7270/Q2D21WX8
More data for this
Ligand-Target Pair
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