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Compile Data Set for Download or QSAR

Found 8 hits of ph data with Target = 'Phosphoglycerate kinase 1'   
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
Phosphoglycerate kinase 1


(Homo sapiens)
BDBM50216719
PNG
(CHEMBL348433)
Show SMILES OP(O)(=O)C(Cl)c1cccc(n1)C(Cl)P(O)(O)=O
Show InChI InChI=1S/C7H9Cl2NO6P2/c8-6(17(11,12)13)4-2-1-3-5(10-4)7(9)18(14,15)16/h1-3,6-7H,(H2,11,12,13)(H2,14,15,16)
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Article
PubMed
330n/an/an/an/an/an/a7.1n/a



Sheffield University

Curated by ChEMBL


Assay Description
Binding affinity was evaluated towards 3-phosphoglycerate kinase at 37 degrees Celsius in 0.1 m NaCl pH 7.1


Bioorg Med Chem Lett 8: 515-20 (1998)


Article DOI: 10.1016/s0960-894x(98)00059-6
More data for this
Ligand-Target Pair
Phosphoglycerate kinase 1


(Homo sapiens)
BDBM50216635
PNG
(CHEMBL356436)
Show SMILES OP(O)(=O)C(F)c1cccc(c1)C(F)P(O)(O)=O
Show InChI InChI=1S/C8H10F2O6P2/c9-7(17(11,12)13)5-2-1-3-6(4-5)8(10)18(14,15)16/h1-4,7-8H,(H2,11,12,13)(H2,14,15,16)
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UniChem

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Article
PubMed
690n/an/an/an/an/an/a7.1n/a



Sheffield University

Curated by ChEMBL


Assay Description
Binding affinity was evaluated towards 3-phosphoglycerate kinase at 37 degrees Celsius in 0.1 m NaCl pH 7.1


Bioorg Med Chem Lett 8: 515-20 (1998)


Article DOI: 10.1016/s0960-894x(98)00059-6
More data for this
Ligand-Target Pair
Phosphoglycerate kinase 1


(Homo sapiens)
BDBM50216724
PNG
(CHEMBL356430)
Show SMILES OP(O)(=O)CC(=C)CP(O)(O)=O
Show InChI InChI=1S/C4H10O6P2/c1-4(2-11(5,6)7)3-12(8,9)10/h1-3H2,(H2,5,6,7)(H2,8,9,10)
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UniChem

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Article
PubMed
6.10E+4n/an/an/an/an/an/a7.1n/a



Sheffield University

Curated by ChEMBL


Assay Description
Binding affinity was evaluated towards 3-phosphoglycerate kinase at 37 degrees Celsius in 0.1 m NaCl pH 7.1


Bioorg Med Chem Lett 8: 515-20 (1998)


Article DOI: 10.1016/s0960-894x(98)00059-6
More data for this
Ligand-Target Pair
Phosphoglycerate kinase 1


(Homo sapiens)
BDBM50216699
PNG
(CHEMBL147415)
Show SMILES OP(O)(=O)C(F)c1cccc(n1)C(F)P(O)(O)=O
Show InChI InChI=1S/C7H9F2NO6P2/c8-6(17(11,12)13)4-2-1-3-5(10-4)7(9)18(14,15)16/h1-3,6-7H,(H2,11,12,13)(H2,14,15,16)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
6.10E+4n/an/an/an/an/an/a7.1n/a



Sheffield University

Curated by ChEMBL


Assay Description
Binding affinity was evaluated towards 3-phosphoglycerate kinase at 37 degrees Celsius in 0.1 m NaCl pH 7.1


Bioorg Med Chem Lett 8: 515-20 (1998)


Article DOI: 10.1016/s0960-894x(98)00059-6
More data for this
Ligand-Target Pair
Phosphoglycerate kinase 1


(Homo sapiens)
BDBM50216698
PNG
(CHEMBL341829)
Show SMILES OC(c1cccc(c1)C(O)P(O)(O)=O)P(O)(O)=O
Show InChI InChI=1S/C8H12O8P2/c9-7(17(11,12)13)5-2-1-3-6(4-5)8(10)18(14,15)16/h1-4,7-10H,(H2,11,12,13)(H2,14,15,16)
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UniProtKB/SwissProt

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UniChem
Article
PubMed
7.50E+4n/an/an/an/an/an/a7.1n/a



Sheffield University

Curated by ChEMBL


Assay Description
Binding affinity was evaluated towards 3-phosphoglycerate kinase at 37 degrees Celsius in 0.1 m NaCl pH 7.1


Bioorg Med Chem Lett 8: 515-20 (1998)


Article DOI: 10.1016/s0960-894x(98)00059-6
More data for this
Ligand-Target Pair
Phosphoglycerate kinase 1


(Homo sapiens)
BDBM50216703
PNG
(CHEMBL148705)
Show SMILES OP(O)(=O)Cc1cccc(CP(O)(O)=O)n1
Show InChI InChI=1S/C7H11NO6P2/c9-15(10,11)4-6-2-1-3-7(8-6)5-16(12,13)14/h1-3H,4-5H2,(H2,9,10,11)(H2,12,13,14)
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UniChem

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Article
PubMed
8.00E+4n/an/an/an/an/an/a7.1n/a



Sheffield University

Curated by ChEMBL


Assay Description
Binding affinity was evaluated towards 3-phosphoglycerate kinase at 37 degrees Celsius in 0.1 m NaCl pH 7.1


Bioorg Med Chem Lett 8: 515-20 (1998)


Article DOI: 10.1016/s0960-894x(98)00059-6
More data for this
Ligand-Target Pair
Phosphoglycerate kinase 1


(Homo sapiens)
BDBM50216711
PNG
(CHEMBL147362)
Show SMILES OP(O)(=O)Cc1cccc(CP(O)(O)=O)c1
Show InChI InChI=1S/C8H12O6P2/c9-15(10,11)5-7-2-1-3-8(4-7)6-16(12,13)14/h1-4H,5-6H2,(H2,9,10,11)(H2,12,13,14)
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UniProtKB/SwissProt

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PC sid
UniChem

Patents


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Article
PubMed
1.20E+5n/an/an/an/an/an/a7.1n/a



Sheffield University

Curated by ChEMBL


Assay Description
Binding affinity was evaluated towards 3-phosphoglycerate kinase at 37 degrees Celsius in 0.1 m NaCl pH 7.1


Bioorg Med Chem Lett 8: 515-20 (1998)


Article DOI: 10.1016/s0960-894x(98)00059-6
More data for this
Ligand-Target Pair
Phosphoglycerate kinase 1


(Homo sapiens)
BDBM50216697
PNG
(CHEMBL357982)
Show SMILES OC(c1cccc(n1)C(O)P(O)(O)=O)P(O)(O)=O
Show InChI InChI=1S/C7H11NO8P2/c9-6(17(11,12)13)4-2-1-3-5(8-4)7(10)18(14,15)16/h1-3,6-7,9-10H,(H2,11,12,13)(H2,14,15,16)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
1.56E+5n/an/an/an/an/an/a7.1n/a



Sheffield University

Curated by ChEMBL


Assay Description
Binding affinity was evaluated towards 3-phosphoglycerate kinase at 37 degrees Celsius in 0.1 m NaCl pH 7.1


Bioorg Med Chem Lett 8: 515-20 (1998)


Article DOI: 10.1016/s0960-894x(98)00059-6
More data for this
Ligand-Target Pair