Found 7 hits of kd data for polymerid = 50002756,50002926,50003406 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 |
3-dehydroquinate dehydratase
(Helicobacter pylori) | BDBM14672
(2-hydroxypropane-1,2,3-tricarboxylic acid | CHEMBL...)Show InChI InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a | n/a |
University of Glasgow
Curated by ChEMBL
| Assay Description Binding affinity for Helicobacter pylori DHQase 2 |
J Med Chem 49: 1282-90 (2006)
Article DOI: 10.1021/jm0505361 BindingDB Entry DOI: 10.7270/Q27P8XZF |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
3-dehydroquinate dehydratase
(Streptomyces coelicolor) | BDBM14672
(2-hydroxypropane-1,2,3-tricarboxylic acid | CHEMBL...)Show InChI InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 7.30E+3 | n/a | n/a | n/a | n/a | n/a |
University of Glasgow
Curated by ChEMBL
| Assay Description Binding affinity for Streptomyces coelicolor DHQase 2 |
J Med Chem 49: 1282-90 (2006)
Article DOI: 10.1021/jm0505361 BindingDB Entry DOI: 10.7270/Q27P8XZF |
More data for this Ligand-Target Pair | |
3-dehydroquinate dehydratase
(Helicobacter pylori) | BDBM50182477
(CHEMBL202311 | N-TETRAZOL-5-YL 9-OXO-9H-XANTHENE-2...)Show SMILES O=c1c2ccccc2oc2ccc(cc12)S(=O)(=O)Nc1nnn[nH]1 Show InChI InChI=1S/C14H9N5O4S/c20-13-9-3-1-2-4-11(9)23-12-6-5-8(7-10(12)13)24(21,22)17-14-15-18-19-16-14/h1-7H,(H2,15,16,17,18,19) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid UniChem
| MMDB Article PubMed
| n/a | n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a | n/a |
University of Glasgow
Curated by ChEMBL
| Assay Description Binding affinity for Helicobacter pylori DHQase 2 |
J Med Chem 49: 1282-90 (2006)
Article DOI: 10.1021/jm0505361 BindingDB Entry DOI: 10.7270/Q27P8XZF |
More data for this Ligand-Target Pair | |
3-dehydroquinate dehydratase
(Streptomyces coelicolor) | BDBM50170812
((1R,4R,5R)-1,4,5-Trihydroxy-cyclohex-2-enecarboxyl...)Show InChI InChI=1S/C7H10O5/c8-4-1-2-7(12,6(10)11)3-5(4)9/h1-2,4-5,8-9,12H,3H2,(H,10,11)/t4-,5-,7+/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid PDB UniChem
| PDB Article PubMed
| n/a | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a | n/a |
University of Glasgow
Curated by ChEMBL
| Assay Description Binding affinity for Streptomyces coelicolor DHQase 2 |
J Med Chem 49: 1282-90 (2006)
Article DOI: 10.1021/jm0505361 BindingDB Entry DOI: 10.7270/Q27P8XZF |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
3-dehydroquinate dehydratase
(Mycobacterium tuberculosis) | BDBM50170812
((1R,4R,5R)-1,4,5-Trihydroxy-cyclohex-2-enecarboxyl...)Show InChI InChI=1S/C7H10O5/c8-4-1-2-7(12,6(10)11)3-5(4)9/h1-2,4-5,8-9,12H,3H2,(H,10,11)/t4-,5-,7+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid PDB UniChem
| MMDB PDB Article PubMed
| n/a | n/a | n/a | 2.00E+5 | n/a | n/a | n/a | n/a | n/a |
University of Glasgow
Curated by ChEMBL
| Assay Description Binding affinity for Mycobacterium tuberculosis DHQase 2 |
J Med Chem 49: 1282-90 (2006)
Article DOI: 10.1021/jm0505361 BindingDB Entry DOI: 10.7270/Q27P8XZF |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
3-dehydroquinate dehydratase
(Streptomyces coelicolor) | BDBM50182477
(CHEMBL202311 | N-TETRAZOL-5-YL 9-OXO-9H-XANTHENE-2...)Show SMILES O=c1c2ccccc2oc2ccc(cc12)S(=O)(=O)Nc1nnn[nH]1 Show InChI InChI=1S/C14H9N5O4S/c20-13-9-3-1-2-4-11(9)23-12-6-5-8(7-10(12)13)24(21,22)17-14-15-18-19-16-14/h1-7H,(H2,15,16,17,18,19) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 2.30E+5 | n/a | n/a | n/a | n/a | n/a |
University of Glasgow
Curated by ChEMBL
| Assay Description Binding affinity for Streptomyces coelicolor DHQase 2 |
J Med Chem 49: 1282-90 (2006)
Article DOI: 10.1021/jm0505361 BindingDB Entry DOI: 10.7270/Q27P8XZF |
More data for this Ligand-Target Pair | |
3-dehydroquinate dehydratase
(Helicobacter pylori) | BDBM50170812
((1R,4R,5R)-1,4,5-Trihydroxy-cyclohex-2-enecarboxyl...)Show InChI InChI=1S/C7H10O5/c8-4-1-2-7(12,6(10)11)3-5(4)9/h1-2,4-5,8-9,12H,3H2,(H,10,11)/t4-,5-,7+/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL MMDB PC cid PC sid PDB UniChem
| PDB Article PubMed
| n/a | n/a | n/a | 3.70E+5 | n/a | n/a | n/a | n/a | n/a |
University of Glasgow
Curated by ChEMBL
| Assay Description Binding affinity for Helicobacter pylori DHQase 2 |
J Med Chem 49: 1282-90 (2006)
Article DOI: 10.1021/jm0505361 BindingDB Entry DOI: 10.7270/Q27P8XZF |
More data for this Ligand-Target Pair | 3D Structure (crystal) |