Found 14 hits Enz. Inhib. hit(s) with all data for entry = 50045743 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 |
|---|
Cell division protein FtsZ
(Staphylococcus aureus) | BDBM50079356
(CHEMBL511201)Show InChI InChI=1S/C14H8ClF2N3O2S/c15-6-3-8-14(19-4-6)23-10(20-8)5-22-9-2-1-7(16)11(12(9)17)13(18)21/h1-4H,5H2,(H2,18,21) | PDB
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Article
PubMed
| n/a | n/a | 154 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus FtsZ GTPase activity |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Cell division protein FtsZ
(Escherichia coli) | BDBM50203065
(3-phenylacrylaldehyde | 3-phenylprop-2-enal | CHEM...)Show InChI InChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+ | PDB
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UniChem
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| Article
PubMed
| n/a | n/a | 5.81E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ GTPase activity |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50203065
(3-phenylacrylaldehyde | 3-phenylprop-2-enal | CHEM...)Show InChI InChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+ | PDB
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| Article
PubMed
| n/a | n/a | 6.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ polymerization |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50079361
(CHEMBL3416824)Show SMILES Oc1ccccc1Cc1ccc(O)c(Cc2c(O)c(Cc3cc(Cc4ccccc4O)ccc3O)c3O[C@@H](CC(=O)c3c2O)c2ccccc2)c1 |r| Show InChI InChI=1S/C43H36O8/c44-34-12-6-4-10-28(34)18-25-14-16-36(46)30(20-25)22-32-41(49)33(23-31-21-26(15-17-37(31)47)19-29-11-5-7-13-35(29)45)43-40(42(32)50)38(48)24-39(51-43)27-8-2-1-3-9-27/h1-17,20-21,39,44-47,49-50H,18-19,22-24H2/t39-/m0/s1 | PDB
UniProtKB/SwissProt
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 8.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ GTPase activity |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50439495
(CHEMBL2418095)Show SMILES Oc1cc(O)c2Oc3cc(C\C=C(Cl)/Cc4cc(O)c(Oc5cc(C\C=C(Cl)/Cc2c1)c(O)cc5Cl)c(O)c4)c(O)cc3Cl |t:11,25| Show InChI InChI=1S/C32H24Cl4O8/c33-19-3-1-16-10-29(22(35)13-24(16)38)43-31-18(9-21(37)12-28(31)42)8-20(34)4-2-17-11-30(23(36)14-25(17)39)44-32-26(40)6-15(5-19)7-27(32)41/h3-4,6-7,9-14,37-42H,1-2,5,8H2/b19-3+,20-4+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ GTPase activity |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50079359
(Viriditoxin)Show SMILES COC(=O)CC1Cc2cc3cc(OC)c(c(O)c3c(O)c2C(=O)O1)-c1c(OC)cc2cc3CC(CC(=O)OC)OC(=O)c3c(O)c2c1O |(-7.16,-4.87,;-5.83,-5.64,;-4.49,-4.86,;-4.49,-3.32,;-3.16,-5.63,;-1.82,-4.86,;-.49,-5.62,;.84,-4.86,;2.16,-5.62,;3.49,-4.86,;4.83,-5.63,;6.16,-4.85,;7.5,-5.62,;7.5,-7.16,;6.16,-3.3,;4.82,-2.54,;4.82,-1,;3.49,-3.31,;2.16,-2.55,;2.16,-1.01,;.84,-3.32,;-.49,-2.54,;-.49,-1,;-1.82,-3.32,;7.48,-2.53,;7.47,-1,;6.13,-.23,;6.12,1.31,;8.8,-.22,;10.14,-.98,;11.46,-.21,;12.8,-.96,;14.12,-.18,;15.47,-.94,;16.8,-.16,;18.14,-.93,;18.15,-2.47,;19.47,-.15,;20.81,-.91,;15.48,-2.49,;14.14,-3.27,;14.15,-4.81,;12.81,-2.51,;11.48,-3.28,;11.49,-4.82,;10.15,-2.52,;8.82,-3.3,;8.83,-4.84,)| Show InChI InChI=1S/C34H30O14/c1-43-19-9-15-5-13-7-17(11-21(35)45-3)47-33(41)25(13)29(37)23(15)31(39)27(19)28-20(44-2)10-16-6-14-8-18(12-22(36)46-4)48-34(42)26(14)30(38)24(16)32(28)40/h5-6,9-10,17-18,37-40H,7-8,11-12H2,1-4H3 | PDB
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| n/a | n/a | 1.05E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ GTPase activity |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50079358
(CHEMBL3416948)Show SMILES CN(C)CCNc1nc(\C=C\c2ccc(Cl)cc2)nc2cc3ccccc3cc12 Show InChI InChI=1S/C24H23ClN4/c1-29(2)14-13-26-24-21-15-18-5-3-4-6-19(18)16-22(21)27-23(28-24)12-9-17-7-10-20(25)11-8-17/h3-12,15-16H,13-14H2,1-2H3,(H,26,27,28)/b12-9+ | PDB
UniProtKB/SwissProt
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| CHEMBL
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50079359
(Viriditoxin)Show SMILES COC(=O)CC1Cc2cc3cc(OC)c(c(O)c3c(O)c2C(=O)O1)-c1c(OC)cc2cc3CC(CC(=O)OC)OC(=O)c3c(O)c2c1O |(-7.16,-4.87,;-5.83,-5.64,;-4.49,-4.86,;-4.49,-3.32,;-3.16,-5.63,;-1.82,-4.86,;-.49,-5.62,;.84,-4.86,;2.16,-5.62,;3.49,-4.86,;4.83,-5.63,;6.16,-4.85,;7.5,-5.62,;7.5,-7.16,;6.16,-3.3,;4.82,-2.54,;4.82,-1,;3.49,-3.31,;2.16,-2.55,;2.16,-1.01,;.84,-3.32,;-.49,-2.54,;-.49,-1,;-1.82,-3.32,;7.48,-2.53,;7.47,-1,;6.13,-.23,;6.12,1.31,;8.8,-.22,;10.14,-.98,;11.46,-.21,;12.8,-.96,;14.12,-.18,;15.47,-.94,;16.8,-.16,;18.14,-.93,;18.15,-2.47,;19.47,-.15,;20.81,-.91,;15.48,-2.49,;14.14,-3.27,;14.15,-4.81,;12.81,-2.51,;11.48,-3.28,;11.49,-4.82,;10.15,-2.52,;8.82,-3.3,;8.83,-4.84,)| Show InChI InChI=1S/C34H30O14/c1-43-19-9-15-5-13-7-17(11-21(35)45-3)47-33(41)25(13)29(37)23(15)31(39)27(19)28-20(44-2)10-16-6-14-8-18(12-22(36)46-4)48-34(42)26(14)30(38)24(16)32(28)40/h5-6,9-10,17-18,37-40H,7-8,11-12H2,1-4H3 | PDB
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| n/a | n/a | 1.23E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ polymerization |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50079360
(CHEBI:69681 | Dichamanetin)Show SMILES Oc1ccccc1Cc1c(O)c(Cc2ccccc2O)c2O[C@@H](CC(=O)c2c1O)c1ccccc1 |r| Show InChI InChI=1S/C29H24O6/c30-22-12-6-4-10-18(22)14-20-27(33)21(15-19-11-5-7-13-23(19)31)29-26(28(20)34)24(32)16-25(35-29)17-8-2-1-3-9-17/h1-13,25,30-31,33-34H,14-16H2/t25-/m0/s1 | PDB
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| n/a | n/a | 1.25E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ GTPase activity |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50439496
(CHEMBL2418096 | US9169182, J23)Show SMILES COc1cc(C\C=C(\Cl)Cc2cc(O)cc(O)c2)c(OC)cc1Cl Show InChI InChI=1S/C18H18Cl2O4/c1-23-17-10-16(20)18(24-2)8-12(17)3-4-13(19)5-11-6-14(21)9-15(22)7-11/h4,6-10,21-22H,3,5H2,1-2H3/b13-4+ | PDB
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
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PubMed
| n/a | n/a | 3.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Escherichia coli FtsZ GTPase activity |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Staphylococcus aureus) | BDBM50439496
(CHEMBL2418096 | US9169182, J23)Show SMILES COc1cc(C\C=C(\Cl)Cc2cc(O)cc(O)c2)c(OC)cc1Cl Show InChI InChI=1S/C18H18Cl2O4/c1-23-17-10-16(20)18(24-2)8-12(17)3-4-13(19)5-11-6-14(21)9-15(22)7-11/h4,6-10,21-22H,3,5H2,1-2H3/b13-4+ | PDB
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of Staphylococcus aureus FtsZ GTPase activity |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Escherichia coli) | BDBM50010058
(CHEBI:51231 | DAPI)Show InChI InChI=1S/C16H15N5/c17-15(18)10-3-1-9(2-4-10)13-7-11-5-6-12(16(19)20)8-14(11)21-13/h1-8,21H,(H3,17,18)(H3,19,20) | PDB
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| n/a | n/a | n/a | 1.66E+4 | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Binding affinity to Escherichia coli FtsZ by fluorescence anisotrophy |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Bacillus subtilis) | BDBM50079357
(CHEMBL3416826)Show SMILES FC(F)(F)c1cccc(c1)-c1ccc(\C=C2\SC(=S)NC2=O)o1 Show InChI InChI=1S/C15H8F3NO2S2/c16-15(17,18)9-3-1-2-8(6-9)11-5-4-10(21-11)7-12-13(20)19-14(22)23-12/h1-7H,(H,19,20,22)/b12-7+ | PDB
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| n/a | n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Binding affinity to Bacillus subtilis FtsZ |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
Cell division protein FtsZ
(Mycobacterium tuberculosis) | BDBM50392993
(TOTAROL)Show SMILES CC(C)c1c(O)ccc2c1CC[C@H]1C(C)(C)CCC[C@]21C |r| Show InChI InChI=1S/C20H30O/c1-13(2)18-14-7-10-17-19(3,4)11-6-12-20(17,5)15(14)8-9-16(18)21/h8-9,13,17,21H,6-7,10-12H2,1-5H3/t17-,20+/m0/s1 | PDB
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| n/a | n/a | n/a | 1.10E+4 | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Binding affinity to Mycobacterium tuberculosis FtsZ |
Eur J Med Chem 95: 1-15 (2015)
Article DOI: 10.1016/j.ejmech.2015.03.026
BindingDB Entry DOI: 10.7270/Q2S75J14 |
More data for this
Ligand-Target Pair | |
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