Found 74 hits with Last Name = 'gage' and Initial = 'jw' 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
(Streptococcus pneumoniae) | BDBM50378451
(CHEMBL578362)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cncnc1)-c1ncc(C)cn1 Show InChI InChI=1S/C19H18N8O/c1-3-22-19(28)26-16-10-27-15(18-23-6-12(2)7-24-18)4-13(5-17(27)25-16)14-8-20-11-21-9-14/h4-11H,3H2,1-2H3,(H2,22,26,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50423645
(Albamycin | Cathomycin | NOVOBIOCIN)Show SMILES [#6]-[#8]-[#6@@H]1-[#6@@H](-[#8]-[#6](-[#7])=O)-[#6@H](-[#8])-[#6@@H](-[#8]-c2ccc3c(-[#8])c(-[#7]-[#6](=O)-c4ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c4)c(=O)oc3c2-[#6])-[#8]C1([#6])[#6] Show InChI InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/t23-,25-,26+,29-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378443
(CHEMBL568020)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccc(C)nc1)-c1ncccn1 Show InChI InChI=1S/C20H19N7O/c1-3-21-20(28)26-17-12-27-16(19-22-7-4-8-23-19)9-15(10-18(27)25-17)14-6-5-13(2)24-11-14/h4-12H,3H2,1-2H3,(H2,21,26,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378425
(CHEMBL565765)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncccn1 Show InChI InChI=1S/C19H17N7O/c1-2-21-19(27)25-16-12-26-15(18-22-7-4-8-23-18)9-14(10-17(26)24-16)13-5-3-6-20-11-13/h3-12H,2H2,1H3,(H2,21,25,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378420
(CHEMBL565750)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccn(CC)c(=O)c1)-c1ncc(C)cn1 Show InChI InChI=1S/C22H23N7O2/c1-4-23-22(31)27-18-13-29-17(21-24-11-14(3)12-25-21)8-16(9-19(29)26-18)15-6-7-28(5-2)20(30)10-15/h6-13H,4-5H2,1-3H3,(H2,23,27,31) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378433
(CHEMBL584265)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1nccc(n1)C(=O)OC Show InChI InChI=1S/C21H19N7O3/c1-3-23-21(30)27-17-12-28-16(19-24-8-6-15(25-19)20(29)31-2)9-14(10-18(28)26-17)13-5-4-7-22-11-13/h4-12H,3H2,1-2H3,(H2,23,27,30) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378426
(CHEMBL577478)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(C)cn1 Show InChI InChI=1S/C20H19N7O/c1-3-22-20(28)26-17-12-27-16(19-23-9-13(2)10-24-19)7-15(8-18(27)25-17)14-5-4-6-21-11-14/h4-12H,3H2,1-2H3,(H2,22,26,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378429
(CHEMBL583049)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(F)cn1 Show InChI InChI=1S/C19H16FN7O/c1-2-22-19(28)26-16-11-27-15(18-23-9-14(20)10-24-18)6-13(7-17(27)25-16)12-4-3-5-21-8-12/h3-11H,2H2,1H3,(H2,22,26,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378450
(CHEMBL578361)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cncnc1)-c1ncccn1 Show InChI InChI=1S/C18H16N8O/c1-2-21-18(27)25-15-10-26-14(17-22-4-3-5-23-17)6-12(7-16(26)24-15)13-8-19-11-20-9-13/h3-11H,2H2,1H3,(H2,21,25,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378438
(CHEMBL577053)Show SMILES CNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(C)cn1 Show InChI InChI=1S/C19H17N7O/c1-12-8-22-18(23-9-12)15-6-14(13-4-3-5-21-10-13)7-17-24-16(11-26(15)17)25-19(27)20-2/h3-11H,1-2H3,(H2,20,25,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 92 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378444
(CHEMBL568021)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccc(C)nc1)-c1ncc(C)cn1 Show InChI InChI=1S/C21H21N7O/c1-4-22-21(29)27-18-12-28-17(20-24-9-13(2)10-25-20)7-16(8-19(28)26-18)15-6-5-14(3)23-11-15/h5-12H,4H2,1-3H3,(H2,22,27,29) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 96 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378421
(CHEMBL578149)Show SMILES CCCn1ccc(cc1=O)-c1cc(-c2ncc(C)cn2)n2cc(NC(=O)NCC)nc2c1 Show InChI InChI=1S/C23H25N7O2/c1-4-7-29-8-6-16(11-21(29)31)17-9-18(22-25-12-15(3)13-26-22)30-14-19(27-20(30)10-17)28-23(32)24-5-2/h6,8-14H,4-5,7H2,1-3H3,(H2,24,28,32) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 97 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378423
(CHEMBL583440)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccn(CC(O)=O)c(=O)c1)-c1ncc(C)cn1 Show InChI InChI=1S/C22H21N7O4/c1-3-23-22(33)27-17-11-29-16(21-24-9-13(2)10-25-21)6-15(7-18(29)26-17)14-4-5-28(12-20(31)32)19(30)8-14/h4-11H,3,12H2,1-2H3,(H,31,32)(H2,23,27,33) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 98 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378447
(CHEMBL577909)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cnc(nc1)N(C)C)-c1nccc(C)n1 Show InChI InChI=1S/C21H23N9O/c1-5-22-21(31)28-17-12-30-16(19-23-7-6-13(2)26-19)8-14(9-18(30)27-17)15-10-24-20(25-11-15)29(3)4/h6-12H,5H2,1-4H3,(H2,22,28,31) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 113 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378445
(CHEMBL565776)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccc(OC)nc1)-c1ncc(C)cn1 Show InChI InChI=1S/C21H21N7O2/c1-4-22-21(29)27-17-12-28-16(20-24-9-13(2)10-25-20)7-15(8-18(28)26-17)14-5-6-19(30-3)23-11-14/h5-12H,4H2,1-3H3,(H2,22,27,29) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 117 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378443
(CHEMBL568020)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccc(C)nc1)-c1ncccn1 Show InChI InChI=1S/C20H19N7O/c1-3-21-20(28)26-17-12-27-16(19-22-7-4-8-23-19)9-15(10-18(27)25-17)14-6-5-13(2)24-11-14/h4-12H,3H2,1-2H3,(H2,21,26,28) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 119 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378452
(CHEMBL583870)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cnc(OC)nc1)-c1ncc(C)cn1 Show InChI InChI=1S/C20H20N8O2/c1-4-21-19(29)27-16-11-28-15(18-22-7-12(2)8-23-18)5-13(6-17(28)26-16)14-9-24-20(30-3)25-10-14/h5-11H,4H2,1-3H3,(H2,21,27,29) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 132 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378448
(CHEMBL577041)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cnc(nc1)N(C)C)-c1ncccn1 Show InChI InChI=1S/C20H21N9O/c1-4-21-20(30)27-16-12-29-15(18-22-6-5-7-23-18)8-13(9-17(29)26-16)14-10-24-19(25-11-14)28(2)3/h5-12H,4H2,1-3H3,(H2,21,27,30) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 137 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378445
(CHEMBL565776)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccc(OC)nc1)-c1ncc(C)cn1 Show InChI InChI=1S/C21H21N7O2/c1-4-22-21(29)27-17-12-28-16(20-24-9-13(2)10-25-20)7-15(8-18(28)26-17)14-5-6-19(30-3)23-11-14/h5-12H,4H2,1-3H3,(H2,22,27,29) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 147 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378430
(CHEMBL568019)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(Cl)cn1 Show InChI InChI=1S/C19H16ClN7O/c1-2-22-19(28)26-16-11-27-15(18-23-9-14(20)10-24-18)6-13(7-17(27)25-16)12-4-3-5-21-8-12/h3-11H,2H2,1H3,(H2,22,26,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 149 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378427
(CHEMBL565572)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(cn1)C(F)(F)F Show InChI InChI=1S/C20H16F3N7O/c1-2-25-19(31)29-16-11-30-15(18-26-9-14(10-27-18)20(21,22)23)6-13(7-17(30)28-16)12-4-3-5-24-8-12/h3-11H,2H2,1H3,(H2,25,29,31) | PDB
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| n/a | n/a | 163 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378435
(CHEMBL578336)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1nc(C)cc(C)n1 Show InChI InChI=1S/C21H21N7O/c1-4-23-21(29)27-18-12-28-17(20-24-13(2)8-14(3)25-20)9-16(10-19(28)26-18)15-6-5-7-22-11-15/h5-12H,4H2,1-3H3,(H2,23,27,29) | PDB
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| n/a | n/a | 198 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit A/B
(Escherichia coli (strain K12)) | BDBM50197073
(3-amino-7-((R)-3-((S)-1-aminoethyl)pyrrolidin-1-yl...)Show SMILES C[C@H](N)[C@@H]1CCN(C1)c1c(F)cc2c(c1C)n(C1CC1)c(=O)n(N)c2=O |r| Show InChI InChI=1S/C18H24FN5O2/c1-9-15-13(17(25)24(21)18(26)23(15)12-3-4-12)7-14(19)16(9)22-6-5-11(8-22)10(2)20/h7,10-12H,3-6,8,20-21H2,1-2H3/t10-,11+/m0/s1 | PDB
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| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli gyrase |
J Med Chem 49: 6435-8 (2006)
Article DOI: 10.1021/jm060505l
BindingDB Entry DOI: 10.7270/Q21N80RC |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit A/B
(Escherichia coli (strain K12)) | BDBM21690
(1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,...)Show InChI InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24) | PDB
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Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli gyrase |
J Med Chem 49: 6435-8 (2006)
Article DOI: 10.1021/jm060505l
BindingDB Entry DOI: 10.7270/Q21N80RC |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378436
(CHEMBL578991)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1nc(C)cc(n1)C(F)(F)F Show InChI InChI=1S/C21H18F3N7O/c1-3-26-20(32)30-17-11-31-15(19-27-12(2)7-16(28-19)21(22,23)24)8-14(9-18(31)29-17)13-5-4-6-25-10-13/h4-11H,3H2,1-2H3,(H2,26,30,32) | PDB
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| n/a | n/a | 216 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378437
(CHEMBL578992)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1nc(cc(n1)C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C21H15F6N7O/c1-2-29-19(35)33-16-10-34-13(6-12(7-17(34)32-16)11-4-3-5-28-9-11)18-30-14(20(22,23)24)8-15(31-18)21(25,26)27/h3-10H,2H2,1H3,(H2,29,33,35) | PDB
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Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378453
(CHEMBL567804)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cnc(nc1)N1CCCC1)-c1ncc(C)cn1 Show InChI InChI=1S/C23H25N9O/c1-3-24-23(33)30-19-14-32-18(21-25-10-15(2)11-26-21)8-16(9-20(32)29-19)17-12-27-22(28-13-17)31-6-4-5-7-31/h8-14H,3-7H2,1-2H3,(H2,24,30,33) | PDB
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| n/a | n/a | 244 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378426
(CHEMBL577478)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(C)cn1 Show InChI InChI=1S/C20H19N7O/c1-3-22-20(28)26-17-12-27-16(19-23-9-13(2)10-24-19)7-15(8-18(27)25-17)14-5-4-6-21-11-14/h4-12H,3H2,1-2H3,(H2,22,26,28) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
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UniChem
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PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378439
(CHEMBL565741)Show SMILES CCC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(C)cn1 Show InChI InChI=1S/C20H18N6O/c1-3-19(27)25-17-12-26-16(20-22-9-13(2)10-23-20)7-15(8-18(26)24-17)14-5-4-6-21-11-14/h4-12H,3H2,1-2H3,(H,25,27) | PDB
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| n/a | n/a | 255 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378451
(CHEMBL578362)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cncnc1)-c1ncc(C)cn1 Show InChI InChI=1S/C19H18N8O/c1-3-22-19(28)26-16-10-27-15(18-23-6-12(2)7-24-18)4-13(5-17(27)25-16)14-8-20-11-21-9-14/h4-11H,3H2,1-2H3,(H2,22,26,28) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 258 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378441
(CHEMBL578138)Show SMILES CCCCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(C)cn1 Show InChI InChI=1S/C22H23N7O/c1-3-4-8-24-22(30)28-19-14-29-18(21-25-11-15(2)12-26-21)9-17(10-20(29)27-19)16-6-5-7-23-13-16/h5-7,9-14H,3-4,8H2,1-2H3,(H2,24,28,30) | PDB
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| n/a | n/a | 261 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378428
(CHEMBL578120)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(CC)cn1 Show InChI InChI=1S/C21H21N7O/c1-3-14-10-24-20(25-11-14)17-8-16(15-6-5-7-22-12-15)9-19-26-18(13-28(17)19)27-21(29)23-4-2/h5-13H,3-4H2,1-2H3,(H2,23,27,29) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 265 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378450
(CHEMBL578361)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cncnc1)-c1ncccn1 Show InChI InChI=1S/C18H16N8O/c1-2-21-18(27)25-15-10-26-14(17-22-4-3-5-23-17)6-12(7-16(26)24-15)13-8-19-11-20-9-13/h3-11H,2H2,1H3,(H2,21,25,27) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378440
(CHEMBL571734)Show SMILES Cc1cnc(nc1)-c1cc(cc2nc(NC(=O)NC3CC3)cn12)-c1cccnc1 Show InChI InChI=1S/C21H19N7O/c1-13-9-23-20(24-10-13)17-7-15(14-3-2-6-22-11-14)8-19-26-18(12-28(17)19)27-21(29)25-16-4-5-16/h2-3,6-12,16H,4-5H2,1H3,(H2,25,27,29) | PDB
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| n/a | n/a | 295 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378434
(CHEMBL565971)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1nccc(n1)C1CC1 Show InChI InChI=1S/C22H21N7O/c1-2-24-22(30)28-19-13-29-18(21-25-9-7-17(26-21)14-5-6-14)10-16(11-20(29)27-19)15-4-3-8-23-12-15/h3-4,7-14H,2,5-6H2,1H3,(H2,24,28,30) | PDB
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| n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378428
(CHEMBL578120)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(CC)cn1 Show InChI InChI=1S/C21H21N7O/c1-3-14-10-24-20(25-11-14)17-8-16(15-6-5-7-22-12-15)9-19-26-18(13-28(17)19)27-21(29)23-4-2/h5-13H,3-4H2,1-2H3,(H2,23,27,29) | PDB
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| n/a | n/a | 353 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378429
(CHEMBL583049)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(F)cn1 Show InChI InChI=1S/C19H16FN7O/c1-2-22-19(28)26-16-11-27-15(18-23-9-14(20)10-24-18)6-13(7-17(27)25-16)12-4-3-5-21-8-12/h3-11H,2H2,1H3,(H2,22,26,28) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 364 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378453
(CHEMBL567804)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cnc(nc1)N1CCCC1)-c1ncc(C)cn1 Show InChI InChI=1S/C23H25N9O/c1-3-24-23(33)30-19-14-32-18(21-25-10-15(2)11-26-21)8-16(9-20(32)29-19)17-12-27-22(28-13-17)31-6-4-5-7-31/h8-14H,3-7H2,1-2H3,(H2,24,30,33) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 366 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378427
(CHEMBL565572)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(cn1)C(F)(F)F Show InChI InChI=1S/C20H16F3N7O/c1-2-25-19(31)29-16-11-30-15(18-26-9-14(10-27-18)20(21,22)23)6-13(7-17(30)28-16)12-4-3-5-24-8-12/h3-11H,2H2,1H3,(H2,25,29,31) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 367 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378442
(CHEMBL577922)Show SMILES CN(C(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(C)cn1)C(F)(F)F Show InChI InChI=1S/C20H16F3N7O/c1-12-8-25-18(26-9-12)15-6-14(13-4-3-5-24-10-13)7-17-27-16(11-30(15)17)28-19(31)29(2)20(21,22)23/h3-11H,1-2H3,(H,28,31) | PDB
KEGG
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PubMed
| n/a | n/a | 368 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378444
(CHEMBL568021)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccc(C)nc1)-c1ncc(C)cn1 Show InChI InChI=1S/C21H21N7O/c1-4-22-21(29)27-18-12-28-17(20-24-9-13(2)10-25-20)7-16(8-19(28)26-18)15-6-5-14(3)23-11-15/h5-12H,4H2,1-3H3,(H2,22,27,29) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 373 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378424
(CHEMBL565743)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccn(CCF)c(=O)c1)-c1ncc(C)cn1 Show InChI InChI=1S/C22H22FN7O2/c1-3-24-22(32)28-18-13-30-17(21-25-11-14(2)12-26-21)8-16(9-19(30)27-18)15-4-6-29(7-5-23)20(31)10-15/h4,6,8-13H,3,5,7H2,1-2H3,(H2,24,28,32) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 376 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378422
(CHEMBL583438)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1ccn(CCOC)c(=O)c1)-c1ncc(C)cn1 Show InChI InChI=1S/C23H25N7O3/c1-4-24-23(32)28-19-14-30-18(22-25-12-15(2)13-26-22)9-17(10-20(30)27-19)16-5-6-29(7-8-33-3)21(31)11-16/h5-6,9-14H,4,7-8H2,1-3H3,(H2,24,28,32) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 401 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378430
(CHEMBL568019)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(Cl)cn1 Show InChI InChI=1S/C19H16ClN7O/c1-2-22-19(28)26-16-11-27-15(18-23-9-14(20)10-24-18)6-13(7-17(27)25-16)12-4-3-5-21-8-12/h3-11H,2H2,1H3,(H2,22,26,28) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 419 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378447
(CHEMBL577909)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cnc(nc1)N(C)C)-c1nccc(C)n1 Show InChI InChI=1S/C21H23N9O/c1-5-22-21(31)28-17-12-30-16(19-23-7-6-13(2)26-19)8-14(9-18(30)27-17)15-10-24-20(25-11-15)29(3)4/h6-12H,5H2,1-4H3,(H2,22,28,31) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 424 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378431
(CHEMBL568222)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(cn1)S(C)(=O)=O Show InChI InChI=1S/C20H19N7O3S/c1-3-22-20(28)26-17-12-27-16(19-23-10-15(11-24-19)31(2,29)30)7-14(8-18(27)25-17)13-5-4-6-21-9-13/h4-12H,3H2,1-2H3,(H2,22,26,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 433 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378425
(CHEMBL565765)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncccn1 Show InChI InChI=1S/C19H17N7O/c1-2-21-19(27)25-16-12-26-15(18-22-7-4-8-23-18)9-14(10-17(26)24-16)13-5-3-6-20-11-13/h3-12H,2H2,1H3,(H2,21,25,27) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 447 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit A/B
(Escherichia coli (strain K12)) | BDBM50117914
(1-Cyclopropyl-1,4-dihydro-6-fluoro-8-methoxy-7-(3-...)Show SMILES COc1c(N2CCNC(C)C2)c(F)cc2c1n(cc(C(O)=O)c2=O)C1CC1 Show InChI InChI=1S/C19H22FN3O4/c1-10-8-22(6-5-21-10)16-14(20)7-12-15(18(16)27-2)23(11-3-4-11)9-13(17(12)24)19(25)26/h7,9-11,21H,3-6,8H2,1-2H3,(H,25,26) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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| Purchase
CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli gyrase |
J Med Chem 49: 6435-8 (2006)
Article DOI: 10.1021/jm060505l
BindingDB Entry DOI: 10.7270/Q21N80RC |
More data for this
Ligand-Target Pair | |
DNA topoisomerase (ATP-hydrolyzing)
(Streptococcus pneumoniae) | BDBM50378442
(CHEMBL577922)Show SMILES CN(C(=O)Nc1cn2c(cc(cc2n1)-c1cccnc1)-c1ncc(C)cn1)C(F)(F)F Show InChI InChI=1S/C20H16F3N7O/c1-12-8-25-18(26-9-12)15-6-14(13-4-3-5-24-10-13)7-17-27-16(11-30(15)17)28-19(31)29(2)20(21,22)23/h3-11H,1-2H3,(H,28,31) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 504 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
DNA gyrase subunit B
(Streptococcus pneumoniae) | BDBM50378449
(CHEMBL576228)Show SMILES CCNC(=O)Nc1cn2c(cc(cc2n1)-c1cnc(nc1)N(C)C)-c1ncc(C)cn1 Show InChI InChI=1S/C21H23N9O/c1-5-22-21(31)28-17-12-30-16(19-23-8-13(2)9-24-19)6-14(7-18(30)27-17)15-10-25-20(26-11-15)29(3)4/h6-12H,5H2,1-4H3,(H2,22,28,31) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 524 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay |
Bioorg Med Chem Lett 19: 5302-6 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.141
BindingDB Entry DOI: 10.7270/Q23X87KD |
More data for this
Ligand-Target Pair | |
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