Found 117 hits with Last Name = 'harjani' and Initial = 'jr' 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 |
Cytochrome P450 1A2
(Homo sapiens (Human)) | BDBM50566354
(CHEMBL4853103) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of CYP1A2 in human liver microsomes assessed as reduction in midazolam 1-hydroxylase activity by . high-pressure liquid chromatography-tan... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c00044 BindingDB Entry DOI: 10.7270/Q2MG7T86 |
More data for this Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50566354
(CHEMBL4853103) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of CYP2C9 in human liver microsomes assessed as reduction in midazolam 1-hydroxylase activity by . high-pressure liquid chromatography-tan... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c00044 BindingDB Entry DOI: 10.7270/Q2MG7T86 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50566354
(CHEMBL4853103) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of CYP3A4 in human liver microsomes assessed as reduction in testosterone 6beta-hydroxylation activity by high-pressure liquid chromatogra... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c00044 BindingDB Entry DOI: 10.7270/Q2MG7T86 |
More data for this Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50566354
(CHEMBL4853103) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of CYP2D6 in human liver microsomes assessed as reduction in midazolam 1-hydroxylase activity by . high-pressure liquid chromatography-tan... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c00044 BindingDB Entry DOI: 10.7270/Q2MG7T86 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50566354
(CHEMBL4853103) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of CYP3A4 in human liver microsomes assessed as reduction in midazolam 1-hydroxylase activity by . high-pressure liquid chromatography-tan... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c00044 BindingDB Entry DOI: 10.7270/Q2MG7T86 |
More data for this Ligand-Target Pair | |
Cytochrome P450 2C19
(Homo sapiens (Human)) | BDBM50566354
(CHEMBL4853103) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of CYP2C19 in human liver microsomes assessed as reduction in midazolam 1-hydroxylase activity by . high-pressure liquid chromatography-ta... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c00044 BindingDB Entry DOI: 10.7270/Q2MG7T86 |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181514
(CHEMBL3819351)Show InChI InChI=1S/C8H8F3N5O2S/c9-8(10,11)2(17)1-19-7-13-3-4(15-7)14-6(12)16-5(3)18/h2,17H,1H2,(H4,12,13,14,15,16,18) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 9.70E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181515
(CHEMBL3819144)Show InChI InChI=1S/C8H11N5O3S/c9-7-11-5-4(6(16)13-7)10-8(12-5)17-2-3(15)1-14/h3,14-15H,1-2H2,(H4,9,10,11,12,13,16) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 8.20E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181516
(CHEMBL3819390)Show InChI InChI=1S/C8H11N5O2S/c9-7-11-5-4(6(15)13-7)10-8(12-5)16-3-1-2-14/h14H,1-3H2,(H4,9,10,11,12,13,15) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 6.80E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181517
(CHEMBL3818353)Show InChI InChI=1S/C7H9N5O2S/c8-6-10-4-3(5(14)12-6)9-7(11-4)15-2-1-13/h13H,1-2H2,(H4,8,9,10,11,12,14) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 8.92E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181518
(CHEMBL3819092)Show SMILES Nc1nc2[nH]c(SCc3ccc(F)c(c3)C#N)nc2c(=O)[nH]1 Show InChI InChI=1S/C13H9FN6OS/c14-8-2-1-6(3-7(8)4-15)5-22-13-17-9-10(19-13)18-12(16)20-11(9)21/h1-3H,5H2,(H4,16,17,18,19,20,21) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181519
(CHEMBL3819017)Show InChI InChI=1S/C13H12FN5OS/c1-6-4-7(2-3-8(6)14)5-21-13-16-9-10(18-13)17-12(15)19-11(9)20/h2-4H,5H2,1H3,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 3.60E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181520
(CHEMBL3818609)Show InChI InChI=1S/C12H9F2N5OS/c13-6-2-1-5(3-7(6)14)4-21-12-16-8-9(18-12)17-11(15)19-10(8)20/h1-3H,4H2,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181521
(CHEMBL3818603)Show InChI InChI=1S/C13H9FN6OS/c14-8-2-1-6(7(3-8)4-15)5-22-13-17-9-10(19-13)18-12(16)20-11(9)21/h1-3H,5H2,(H4,16,17,18,19,20,21) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181522
(CHEMBL3819098)Show InChI InChI=1S/C13H12FN5OS/c1-6-4-8(14)3-2-7(6)5-21-13-16-9-10(18-13)17-12(15)19-11(9)20/h2-4H,5H2,1H3,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 1.97E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181523
(CHEMBL3819281)Show InChI InChI=1S/C13H9FN6OS/c14-8-3-6(4-15)1-2-7(8)5-22-13-17-9-10(19-13)18-12(16)20-11(9)21/h1-3H,5H2,(H4,16,17,18,19,20,21) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181524
(CHEMBL3819161)Show SMILES COc1ccc(CSc2nc3c(nc(N)[nH]c3=O)[nH]2)c(F)c1 Show InChI InChI=1S/C13H12FN5O2S/c1-21-7-3-2-6(8(14)4-7)5-22-13-16-9-10(18-13)17-12(15)19-11(9)20/h2-4H,5H2,1H3,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181525
(CHEMBL3818521)Show InChI InChI=1S/C12H9F2N5OS/c13-6-2-1-5(7(14)3-6)4-21-12-16-8-9(18-12)17-11(15)19-10(8)20/h1-3H,4H2,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181526
(CHEMBL3818561)Show InChI InChI=1S/C13H12FN5OS/c1-6-2-3-8(14)7(4-6)5-21-13-16-9-10(18-13)17-12(15)19-11(9)20/h2-4H,5H2,1H3,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181527
(CHEMBL3817885)Show InChI InChI=1S/C13H12FN5OS/c1-6-3-2-4-7(8(6)14)5-21-13-16-9-10(18-13)17-12(15)19-11(9)20/h2-4H,5H2,1H3,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181528
(CHEMBL3818245)Show InChI InChI=1S/C14H15N5OS/c1-7-3-4-8(2)9(5-7)6-21-14-16-10-11(18-14)17-13(15)19-12(10)20/h3-5H,6H2,1-2H3,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181529
(CHEMBL3818941)Show InChI InChI=1S/C14H15N5OS/c1-7-4-3-5-9(8(7)2)6-21-14-16-10-11(18-14)17-13(15)19-12(10)20/h3-5H,6H2,1-2H3,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 841 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181530
(CHEMBL3818653)Show SMILES Nc1nc2[nH]c(SCc3cc(cc(c3)C(F)(F)F)C(F)(F)F)nc2c(=O)[nH]1 Show InChI InChI=1S/C14H9F6N5OS/c15-13(16,17)6-1-5(2-7(3-6)14(18,19)20)4-27-12-22-8-9(24-12)23-11(21)25-10(8)26/h1-3H,4H2,(H4,21,22,23,24,25,26) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181531
(CHEMBL3818195)Show InChI InChI=1S/C14H15N5OS/c1-7-3-8(2)5-9(4-7)6-21-14-16-10-11(18-14)17-13(15)19-12(10)20/h3-5H,6H2,1-2H3,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181533
(CHEMBL3817872)Show InChI InChI=1S/C12H9F2N5OS/c13-6-2-1-3-7(14)5(6)4-21-12-16-8-9(18-12)17-11(15)19-10(8)20/h1-3H,4H2,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181536
(CHEMBL3818636)Show SMILES Nc1nc2[nH]c(SCc3ccc(OC(F)(F)F)cc3)nc2c(=O)[nH]1 Show InChI InChI=1S/C13H10F3N5O2S/c14-13(15,16)23-7-3-1-6(2-4-7)5-24-12-18-8-9(20-12)19-11(17)21-10(8)22/h1-4H,5H2,(H4,17,18,19,20,21,22) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181541
(CHEMBL3817986)Show SMILES Nc1nc2[nH]c(SCc3ccc(cc3)C(F)(F)F)nc2c(=O)[nH]1 Show InChI InChI=1S/C13H10F3N5OS/c14-13(15,16)7-3-1-6(2-4-7)5-23-12-18-8-9(20-12)19-11(17)21-10(8)22/h1-4H,5H2,(H4,17,18,19,20,21,22) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 1.93E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181543
(CHEMBL3818008)Show InChI InChI=1S/C13H13N5O2S/c1-20-8-4-2-7(3-5-8)6-21-13-15-9-10(17-13)16-12(14)18-11(9)19/h2-5H,6H2,1H3,(H4,14,15,16,17,18,19) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 520 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181545
(CHEMBL3818002)Show InChI InChI=1S/C12H10BrN5OS/c13-7-3-1-6(2-4-7)5-20-12-15-8-9(17-12)16-11(14)18-10(8)19/h1-4H,5H2,(H4,14,15,16,17,18,19) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 950 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50125760
(2-Amino-8-(4-chloro-benzylsulfanyl)-1,9-dihydro-pu...)Show InChI InChI=1S/C12H10ClN5OS/c13-7-3-1-6(2-4-7)5-20-12-15-8-9(17-12)16-11(14)18-10(8)19/h1-4H,5H2,(H4,14,15,16,17,18,19) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 1.24E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181546
(CHEMBL3819104)Show InChI InChI=1S/C12H10FN5OS/c13-7-3-1-6(2-4-7)5-20-12-15-8-9(17-12)16-11(14)18-10(8)19/h1-4H,5H2,(H4,14,15,16,17,18,19) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181548
(CHEMBL3818498)Show SMILES Nc1nc2[nH]c(SCc3cccc(c3)C(O)=O)nc2c(=O)[nH]1 Show InChI InChI=1S/C13H11N5O3S/c14-12-16-9-8(10(19)18-12)15-13(17-9)22-5-6-2-1-3-7(4-6)11(20)21/h1-4H,5H2,(H,20,21)(H4,14,15,16,17,18,19) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181551
(CHEMBL3819223)Show InChI InChI=1S/C13H10N6OS/c14-5-7-2-1-3-8(4-7)6-21-13-16-9-10(18-13)17-12(15)19-11(9)20/h1-4H,6H2,(H4,15,16,17,18,19,20) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 770 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181555
(CHEMBL3819267)Show SMILES Nc1nc2[nH]c(SCc3cccc(c3)[N+]([O-])=O)nc2c(=O)[nH]1 Show InChI InChI=1S/C12H10N6O3S/c13-11-15-9-8(10(19)17-11)14-12(16-9)22-5-6-2-1-3-7(4-6)18(20)21/h1-4H,5H2,(H4,13,14,15,16,17,19) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181835
(CHEMBL3818912)Show SMILES Nc1nc2[nH]c(SCc3cccc(OC(F)(F)F)c3)nc2c(=O)[nH]1 Show InChI InChI=1S/C13H10F3N5O2S/c14-13(15,16)23-7-3-1-2-6(4-7)5-24-12-18-8-9(20-12)19-11(17)21-10(8)22/h1-4H,5H2,(H4,17,18,19,20,21,22) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.61E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50182024
(CHEMBL3819246)Show InChI InChI=1S/C12H10ClN5OS/c13-7-3-1-2-6(4-7)5-20-12-15-8-9(17-12)16-11(14)18-10(8)19/h1-4H,5H2,(H4,14,15,16,17,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50182027
(CHEMBL3819387)Show InChI InChI=1S/C12H10FN5OS/c13-7-3-1-2-6(4-7)5-20-12-15-8-9(17-12)16-11(14)18-10(8)19/h1-4H,5H2,(H4,14,15,16,17,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50182026
(CHEMBL3818695)Show InChI InChI=1S/C13H10N6OS/c14-5-7-3-1-2-4-8(7)6-21-13-16-9-10(18-13)17-12(15)19-11(9)20/h1-4H,6H2,(H4,15,16,17,18,19,20) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.30E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181864
(CHEMBL3818368)Show SMILES Nc1nc2[nH]c(SCc3ccccc3[N+]([O-])=O)nc2c(=O)[nH]1 Show InChI InChI=1S/C12H10N6O3S/c13-11-15-9-8(10(19)17-11)14-12(16-9)22-5-6-3-1-2-4-7(6)18(20)21/h1-4H,5H2,(H4,13,14,15,16,17,19) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 5.70E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181863
(CHEMBL3818011)Show InChI InChI=1S/C13H13N5OS/c1-7-4-2-3-5-8(7)6-20-13-15-9-10(17-13)16-12(14)18-11(9)19/h2-5H,6H2,1H3,(H4,14,15,16,17,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181866
(CHEMBL3819638)Show InChI InChI=1S/C12H10BrN5OS/c13-7-4-2-1-3-6(7)5-20-12-15-8-9(17-12)16-11(14)18-10(8)19/h1-4H,5H2,(H4,14,15,16,17,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 8.50E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181848
(CHEMBL3818894)Show SMILES Nc1nc2[nH]c(SCC(=O)c3ccc(Br)cc3)nc2c(=O)[nH]1 Show InChI InChI=1S/C13H10BrN5O2S/c14-7-3-1-6(2-4-7)8(20)5-22-13-16-9-10(18-13)17-12(15)19-11(9)21/h1-4H,5H2,(H4,15,16,17,18,19,21) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Patents
| PDB Article PubMed
| n/a | n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181847
(CHEMBL3819275)Show InChI InChI=1S/C11H16N6O2S/c1-4-17(3)9(19)5(2)20-11-13-6-7(15-11)14-10(12)16-8(6)18/h5H,4H2,1-3H3,(H4,12,13,14,15,16,18) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | n/a | 1.20E+5 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase
(Staphylococcus aureus) | BDBM50181517
(CHEMBL3818353)Show InChI InChI=1S/C7H9N5O2S/c8-6-10-4-3(5(14)12-6)9-7(11-4)15-2-1-13/h13H,1-2H2,(H4,8,9,10,11,12,14) | PDB
KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 7.60E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50182025
(CHEMBL3818754)Show InChI InChI=1S/C12H10BrN5OS/c13-7-3-1-2-6(4-7)5-20-12-15-8-9(17-12)16-11(14)18-10(8)19/h1-4H,5H2,(H4,14,15,16,17,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 7.10E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181898
(CHEMBL3818099)Show InChI InChI=1S/C11H16N6O2S/c1-5(2)3-13-6(18)4-20-11-14-7-8(16-11)15-10(12)17-9(7)19/h5H,3-4H2,1-2H3,(H,13,18)(H4,12,14,15,16,17,19) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 5.94E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181523
(CHEMBL3819281)Show InChI InChI=1S/C13H9FN6OS/c14-8-3-6(4-15)1-2-7(8)5-22-13-17-9-10(19-13)18-12(16)20-11(9)21/h1-3H,5H2,(H4,16,17,18,19,20,21) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50181901
(CHEMBL3819615)Show InChI InChI=1S/C8H10N6O2S/c1-10-3(15)2-17-8-11-4-5(13-8)12-7(9)14-6(4)16/h2H2,1H3,(H,10,15)(H4,9,11,12,13,14,16) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 5.00E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50182029
(CHEMBL3818168)Show InChI InChI=1S/C11H15N5O3S/c12-10-14-8-7(9(17)16-10)13-11(15-8)20-5-2-6-18-3-1-4-19-6/h6H,1-5H2,(H4,12,13,14,15,16,17) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 2.33E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |
2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase
(Escherichia coli (strain K12)) | BDBM50182028
(CHEMBL3818744)Show InChI InChI=1S/C8H11N5O2S/c1-15-2-3-16-8-10-4-5(12-8)11-7(9)13-6(4)14/h2-3H2,1H3,(H4,9,10,11,12,13,14) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | 5.20E+4 | n/a | n/a | n/a | n/a | n/a |
Monash University
Curated by ChEMBL
| Assay Description Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assay |
J Med Chem 59: 5248-63 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00002 BindingDB Entry DOI: 10.7270/Q2057HWV |
More data for this Ligand-Target Pair | |