Found 8 hits of Enzyme Inhibition Constant Data 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 |
|---|
DNA gyrase subunit B
(Staphylococcus aureus) | BDBM50135114
(CHEMBL3742072)Show SMILES [Na+].[Na+].CCCOc1nccc2c(n[nH]c12)-c1cnc(s1)-c1ccc(COP([O-])([O-])=O)nc1 Show InChI InChI=1S/C18H18N5O5PS.2Na/c1-2-7-27-17-16-13(5-6-19-17)15(22-23-16)14-9-21-18(30-14)11-3-4-12(20-8-11)10-28-29(24,25)26;;/h3-6,8-9H,2,7,10H2,1H3,(H,22,23)(H2,24,25,26);;/q;2*+1/p-2 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <8 | n/a | n/a | n/a | n/a | n/a | n/a |
Cubist Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus Gyrase B ATPase activity by fluorescence analysis |
ACS Med Chem Lett 6: 1080-5 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00266
BindingDB Entry DOI: 10.7270/Q2GB25VF |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Staphylococcus aureus) | BDBM50135115
(CHEMBL3741066)Show SMILES CCCOc1nccc2c(n[nH]c12)-c1cnc(s1)-c1ccc(CO)nc1 Show InChI InChI=1S/C18H17N5O2S/c1-2-7-25-17-16-13(5-6-19-17)15(22-23-16)14-9-21-18(26-14)11-3-4-12(10-24)20-8-11/h3-6,8-9,24H,2,7,10H2,1H3,(H,22,23) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <8 | n/a | n/a | n/a | n/a | n/a | n/a |
Cubist Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus Gyrase B ATPase activity by fluorescence analysis |
ACS Med Chem Lett 6: 1080-5 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00266
BindingDB Entry DOI: 10.7270/Q2GB25VF |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Staphylococcus aureus) | BDBM50135116
(CHEMBL3740365)Show SMILES CCCOc1nccc2c(n[nH]c12)-c1cnc(s1)-c1ccc(nc1)C(O)=O Show InChI InChI=1S/C18H15N5O3S/c1-2-7-26-16-15-11(5-6-19-16)14(22-23-15)13-9-21-17(27-13)10-3-4-12(18(24)25)20-8-10/h3-6,8-9H,2,7H2,1H3,(H,22,23)(H,24,25) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | <8 | n/a | n/a | n/a | n/a | n/a | n/a |
Cubist Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus Gyrase B ATPase activity by fluorescence analysis |
ACS Med Chem Lett 6: 1080-5 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00266
BindingDB Entry DOI: 10.7270/Q2GB25VF |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Staphylococcus aureus) | BDBM50134212
(CHEMBL3741453)Show SMILES CCCn1c2[nH]nc(-c3cnc(s3)-c3ccc(nc3)C(O)=O)c2ccc1=O Show InChI InChI=1S/C18H15N5O3S/c1-2-7-23-14(24)6-4-11-15(21-22-16(11)23)13-9-20-17(27-13)10-3-5-12(18(25)26)19-8-10/h3-6,8-9H,2,7H2,1H3,(H,21,22)(H,25,26) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | <8 | n/a | n/a | n/a | n/a | n/a | n/a |
Cubist Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus Gyrase B ATPase activity by fluorescence analysis |
ACS Med Chem Lett 6: 1080-5 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00266
BindingDB Entry DOI: 10.7270/Q2GB25VF |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Staphylococcus aureus) | BDBM50134213
(CHEMBL3741270)Show SMILES CCCc1cccc2c(n[nH]c12)-c1cnc(s1)-c1ccc(nc1)C(O)=O Show InChI InChI=1S/C19H16N4O2S/c1-2-4-11-5-3-6-13-16(11)22-23-17(13)15-10-21-18(26-15)12-7-8-14(19(24)25)20-9-12/h3,5-10H,2,4H2,1H3,(H,22,23)(H,24,25) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Cubist Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus Gyrase B ATPase activity by fluorescence analysis |
ACS Med Chem Lett 6: 1080-5 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00266
BindingDB Entry DOI: 10.7270/Q2GB25VF |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Staphylococcus aureus) | BDBM50135112
(CHEMBL3739453)Show SMILES CCCc1cccc2c(n[nH]c12)-c1cnc(s1)-c1ccnc(c1)C(O)=O Show InChI InChI=1S/C19H16N4O2S/c1-2-4-11-5-3-6-13-16(11)22-23-17(13)15-10-21-18(26-15)12-7-8-20-14(9-12)19(24)25/h3,5-10H,2,4H2,1H3,(H,22,23)(H,24,25) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Cubist Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus Gyrase B ATPase activity by fluorescence analysis |
ACS Med Chem Lett 6: 1080-5 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00266
BindingDB Entry DOI: 10.7270/Q2GB25VF |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Staphylococcus aureus) | BDBM50135111
(CHEMBL3739684)Show SMILES CCCc1cccc2c(n[nH]c12)-c1cnc(s1)-c1ccc(nc1)C(=O)NCCN1CCCCC1 Show InChI InChI=1S/C26H30N6OS/c1-2-7-18-8-6-9-20-23(18)30-31-24(20)22-17-29-26(34-22)19-10-11-21(28-16-19)25(33)27-12-15-32-13-4-3-5-14-32/h6,8-11,16-17H,2-5,7,12-15H2,1H3,(H,27,33)(H,30,31) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Cubist Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus Gyrase B ATPase activity by fluorescence analysis |
ACS Med Chem Lett 6: 1080-5 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00266
BindingDB Entry DOI: 10.7270/Q2GB25VF |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Staphylococcus aureus) | BDBM50135113
(CHEMBL3741416)Show SMILES CCCc1cccc2c(n[nH]c12)-c1cnc(s1)-c1ccc(CC(O)=O)nc1 Show InChI InChI=1S/C20H18N4O2S/c1-2-4-12-5-3-6-15-18(12)23-24-19(15)16-11-22-20(27-16)13-7-8-14(21-10-13)9-17(25)26/h3,5-8,10-11H,2,4,9H2,1H3,(H,23,24)(H,25,26) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Cubist Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus Gyrase B ATPase activity by fluorescence analysis |
ACS Med Chem Lett 6: 1080-5 (2015)
Article DOI: 10.1021/acsmedchemlett.5b00266
BindingDB Entry DOI: 10.7270/Q2GB25VF |
More data for this
Ligand-Target Pair | |
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