Found 8 hits of ki data for polymerid = 50004528 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 |
6-phosphogluconate dehydrogenase, decarboxylating
(Ovis aries) | BDBM50148765
(1-(hydroxyamino)-1-oxo-4-(phosphonooxy)butane-2,3-...)Show SMILES CC(=O)O[C@H](COP(O)(O)=O)[C@@H](OC(C)=O)C(=O)NO Show InChI InChI=1S/C8H14NO10P/c1-4(10)18-6(3-17-20(14,15)16)7(8(12)9-13)19-5(2)11/h6-7,13H,3H2,1-2H3,(H,9,12)(H2,14,15,16)/t6-,7-/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 360 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee
Curated by ChEMBL
| Assay Description Inhibition of sheep 6PGDH expressed in Escherichia coli by spectroscopy |
Bioorg Med Chem 18: 5056-62 (2010)
Article DOI: 10.1016/j.bmc.2010.05.077 BindingDB Entry DOI: 10.7270/Q2X34ZDH |
More data for this Ligand-Target Pair | |
6-phosphogluconate dehydrogenase, decarboxylating
(Ovis aries) | BDBM50148765
(1-(hydroxyamino)-1-oxo-4-(phosphonooxy)butane-2,3-...)Show SMILES CC(=O)O[C@H](COP(O)(O)=O)[C@@H](OC(C)=O)C(=O)NO Show InChI InChI=1S/C8H14NO10P/c1-4(10)18-6(3-17-20(14,15)16)7(8(12)9-13)19-5(2)11/h6-7,13H,3H2,1-2H3,(H,9,12)(H2,14,15,16)/t6-,7-/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 360 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan
Curated by ChEMBL
| Assay Description Inhibition of sheep 6-phosphogluconate dehydrogenase |
Bioorg Med Chem Lett 21: 2679-82 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.066 BindingDB Entry DOI: 10.7270/Q20C4W2K |
More data for this Ligand-Target Pair | |
6-phosphogluconate dehydrogenase, decarboxylating
(Ovis aries) | BDBM50148780
(((4R,5R)-5-(hydroxycarbamoyl)-2,2-dimethyl-1,3-dio...)Show InChI InChI=1S/C7H14NO8P/c1-7(2)15-4(3-14-17(11,12)13)5(16-7)6(9)8-10/h4-5,10H,3H2,1-2H3,(H,8,9)(H2,11,12,13)/t4-,5-/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee
Curated by ChEMBL
| Assay Description Inhibition of sheep 6PGDH expressed in Escherichia coli by spectroscopy |
Bioorg Med Chem 18: 5056-62 (2010)
Article DOI: 10.1016/j.bmc.2010.05.077 BindingDB Entry DOI: 10.7270/Q2X34ZDH |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
6-phosphogluconate dehydrogenase, decarboxylating
(Ovis aries) | BDBM50148780
(((4R,5R)-5-(hydroxycarbamoyl)-2,2-dimethyl-1,3-dio...)Show InChI InChI=1S/C7H14NO8P/c1-7(2)15-4(3-14-17(11,12)13)5(16-7)6(9)8-10/h4-5,10H,3H2,1-2H3,(H,8,9)(H2,11,12,13)/t4-,5-/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee
Curated by ChEMBL
| Assay Description Inhibition of sheep 6PGDH |
J Med Chem 53: 6071-8 (2010)
Article DOI: 10.1021/jm1004754 BindingDB Entry DOI: 10.7270/Q2Q81D8T |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
6-phosphogluconate dehydrogenase, decarboxylating
(Ovis aries) | BDBM50148767
(2,3-dihydroxy-4-(hydroxyamino)-4-oxobutyl dihydrog...)Show InChI InChI=1S/C4H10NO8P/c6-2(1-13-14(10,11)12)3(7)4(8)5-9/h2-3,6-7,9H,1H2,(H,5,8)(H2,10,11,12)/t2-,3-/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| 2.54E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee
Curated by ChEMBL
| Assay Description Inhibition of sheep 6PGDH expressed in Escherichia coli by spectroscopy |
Bioorg Med Chem 18: 5056-62 (2010)
Article DOI: 10.1016/j.bmc.2010.05.077 BindingDB Entry DOI: 10.7270/Q2X34ZDH |
More data for this Ligand-Target Pair | |
6-phosphogluconate dehydrogenase, decarboxylating
(Ovis aries) | BDBM50148790
((2R,3R)-2,3-Dihydroxy-4-phosphonooxy-butyric acid ...)Show InChI InChI=1S/C4H9O8P/c5-2(3(6)4(7)8)1-12-13(9,10)11/h2-3,5-6H,1H2,(H,7,8)(H2,9,10,11)/p-1/t2-,3-/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| Purchase
KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 1.08E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee
Curated by ChEMBL
| Assay Description Inhibition of sheep 6PGDH expressed in Escherichia coli by spectroscopy |
Bioorg Med Chem 18: 5056-62 (2010)
Article DOI: 10.1016/j.bmc.2010.05.077 BindingDB Entry DOI: 10.7270/Q2X34ZDH |
More data for this Ligand-Target Pair | |
6-phosphogluconate dehydrogenase, decarboxylating
(Ovis aries) | BDBM50322321
(5-phospho-D-ribonate | CHEMBL1173785)Show SMILES O[C@@H](COP(O)(O)=O)[C@H](O)[C@H](O)C(O)=O |r| Show InChI InChI=1S/C5H11O9P/c6-2(1-14-15(11,12)13)3(7)4(8)5(9)10/h2-4,6-8H,1H2,(H,9,10)(H2,11,12,13)/t2-,3-,4-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 6.65E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee
Curated by ChEMBL
| Assay Description Inhibition of sheep 6PGDH expressed in Escherichia coli by spectroscopy |
Bioorg Med Chem 18: 5056-62 (2010)
Article DOI: 10.1016/j.bmc.2010.05.077 BindingDB Entry DOI: 10.7270/Q2X34ZDH |
More data for this Ligand-Target Pair | |
6-phosphogluconate dehydrogenase, decarboxylating
(Ovis aries) | BDBM50322320
(2-deoxy-6-phospho-D-gluconate | CHEMBL1173784)Show SMILES O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)CC(O)=O |r| Show InChI InChI=1S/C6H13O9P/c7-3(1-5(9)10)6(11)4(8)2-15-16(12,13)14/h3-4,6-8,11H,1-2H2,(H,9,10)(H2,12,13,14)/t3-,4-,6+/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 7.48E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee
Curated by ChEMBL
| Assay Description Inhibition of sheep 6PGDH expressed in Escherichia coli by spectroscopy |
Bioorg Med Chem 18: 5056-62 (2010)
Article DOI: 10.1016/j.bmc.2010.05.077 BindingDB Entry DOI: 10.7270/Q2X34ZDH |
More data for this Ligand-Target Pair | |