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Found 17 hits Enz. Inhib. hit(s) with Target = 'Penicillin-binding protein 2x'   
Target
(Institution)
LigandTarget
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
pHTemp
°C
Penicillin-binding protein 2x


(Streptococcus pneumoniae)
BDBM50324696
PNG
(CHEMBL1221990 | Phenoxyacetyl lactivicin)
Show SMILES OC(=O)[C@@]1(CCC(=O)O1)N1OC[C@H](NC(=O)COc2ccccc2)C1=O
Show InChI InChI=1S/C16H16N2O8/c19-12(9-24-10-4-2-1-3-5-10)17-11-8-25-18(14(11)21)16(15(22)23)7-6-13(20)26-16/h1-5,11H,6-9H2,(H,17,19)(H,22,23)/t11-,16-/m0/s1
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n/an/a 7.90E+3n/an/an/an/an/an/a



Universit£ Joseph Fourier

Curated by ChEMBL


Assay Description
Inhibition of penicillin-resistant Streptococcus pneumoniae 5204 PBP2x after 60 mins by SDS-PAGE


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2x


(Streptococcus pneumoniae)
BDBM50300689
PNG
(6-chloro-2-(3-(4-chloro-2-methylphenyl)ureido)-3-(...)
Show SMILES Cc1cc(Cl)ccc1NC(=O)Nc1c(Oc2ccc(Cl)cc2)ccc(Cl)c1S(O)(=O)=O
Show InChI InChI=1S/C20H15Cl3N2O5S/c1-11-10-13(22)4-8-16(11)24-20(26)25-18-17(30-14-5-2-12(21)3-6-14)9-7-15(23)19(18)31(27,28)29/h2-10H,1H3,(H2,24,25,26)(H,27,28,29)
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PubMed
n/an/a 7.10E+4n/an/an/an/an/an/a



Institut de Biologie Structurale Jean-Pierre Ebel (CEA/CNRS/UJF)

Curated by ChEMBL


Assay Description
Inhibition of penicillin-resistant Streptococcus pneumoniae 5204 PBP2X preincubated for 4 hrs before addition of substrate (R)-[2-(benzoylamino)propi...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2x


(Streptococcus pneumoniae)
BDBM50300688
PNG
(6-chloro-3-(3,4-dichlorophenoxy)-2-(3-(3-(trifluor...)
Show SMILES OS(=O)(=O)c1c(Cl)ccc(Oc2ccc(Cl)c(Cl)c2)c1NC(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C20H12Cl3F3N2O5S/c21-13-5-4-12(9-15(13)23)33-16-7-6-14(22)18(34(30,31)32)17(16)28-19(29)27-11-3-1-2-10(8-11)20(24,25)26/h1-9H,(H2,27,28,29)(H,30,31,32)
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n/an/a 7.20E+4n/an/an/an/an/an/a



Institut de Biologie Structurale Jean-Pierre Ebel (CEA/CNRS/UJF)

Curated by ChEMBL


Assay Description
Inhibition of penicillin-resistant Streptococcus pneumoniae 5204 PBP2X preincubated for 4 hrs before addition of substrate (R)-[2-(benzoylamino)propi...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50385268
PNG
(CHEMBL2035292)
Show SMILES OB(O)CNC(=O)c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C8H9BN2O5/c12-8(10-5-9(13)14)6-3-1-2-4-7(6)11(15)16/h1-4,13-14H,5H2,(H,10,12)
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n/an/a 1.38E+5n/an/an/an/an/an/a



Universit£ de Li£ge

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2x using S2d as substrate incubated for 60 mins prior to substrate addition by DTNB...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2x


(Streptococcus pneumoniae)
BDBM50324697
PNG
(CHEMBL1221989 | Lactivicin)
Show SMILES CC(=O)N[C@H]1CON(C1=O)[C@]1(CCC(=O)O1)C(O)=O
Show InChI InChI=1S/C10H12N2O7/c1-5(13)11-6-4-18-12(8(6)15)10(9(16)17)3-2-7(14)19-10/h6H,2-4H2,1H3,(H,11,13)(H,16,17)/t6-,10-/m0/s1
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n/an/a 1.50E+5n/an/an/an/an/an/a



Universit£ Joseph Fourier

Curated by ChEMBL


Assay Description
Inhibition of penicillin-resistant Streptococcus pneumoniae 5204 PBP2x after 120 mins by SDS-PAGE


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2x


(Streptococcus pneumoniae)
BDBM50300687
PNG
(2-(5-((4-chlorophenylthio)methyl)-1,3,4-thiadiazol...)
Show SMILES Cc1ccc(Nc2nnc(CSc3ccc(Cl)cc3)s2)c(c1)S(O)(=O)=O
Show InChI InChI=1S/C16H14ClN3O3S3/c1-10-2-7-13(14(8-10)26(21,22)23)18-16-20-19-15(25-16)9-24-12-5-3-11(17)4-6-12/h2-8H,9H2,1H3,(H,18,20)(H,21,22,23)
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n/an/a 2.19E+5n/an/an/an/an/an/a



Institut de Biologie Structurale Jean-Pierre Ebel (CEA/CNRS/UJF)

Curated by ChEMBL


Assay Description
Inhibition of penicillin-resistant Streptococcus pneumoniae 5204 PBP2X preincubated for 4 hrs before addition of substrate (R)-[2-(benzoylamino)propi...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50300688
PNG
(6-chloro-3-(3,4-dichlorophenoxy)-2-(3-(3-(trifluor...)
Show SMILES OS(=O)(=O)c1c(Cl)ccc(Oc2ccc(Cl)c(Cl)c2)c1NC(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C20H12Cl3F3N2O5S/c21-13-5-4-12(9-15(13)23)33-16-7-6-14(22)18(34(30,31)32)17(16)28-19(29)27-11-3-1-2-10(8-11)20(24,25)26/h1-9H,(H2,27,28,29)(H,30,31,32)
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n/an/a 2.55E+5n/an/an/an/an/an/a



Institut de Biologie Structurale Jean-Pierre Ebel (CEA/CNRS/UJF)

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2X preincubated for 1 hr before addition of substrate (R)-[2-(benzoylamino)propiony...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50385263
PNG
(CHEMBL2035289)
Show SMILES OB(O)CNC(=O)c1ccccc1Cl
Show InChI InChI=1S/C8H9BClNO3/c10-7-4-2-1-3-6(7)8(12)11-5-9(13)14/h1-4,13-14H,5H2,(H,11,12)
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n/an/a 2.62E+5n/an/an/an/an/an/a



Universit£ de Li£ge

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2x using S2d as substrate incubated for 60 mins prior to substrate addition by DTNB...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50385267
PNG
(CHEMBL2035284)
Show SMILES COc1cccc(OC)c1C(=O)NCB(O)O
Show InChI InChI=1S/C10H14BNO5/c1-16-7-4-3-5-8(17-2)9(7)10(13)12-6-11(14)15/h3-5,14-15H,6H2,1-2H3,(H,12,13)
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n/an/a 2.78E+5n/an/an/an/an/an/a



Universit£ de Li£ge

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2x using S2d as substrate incubated for 60 mins prior to substrate addition by DTNB...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50300689
PNG
(6-chloro-2-(3-(4-chloro-2-methylphenyl)ureido)-3-(...)
Show SMILES Cc1cc(Cl)ccc1NC(=O)Nc1c(Oc2ccc(Cl)cc2)ccc(Cl)c1S(O)(=O)=O
Show InChI InChI=1S/C20H15Cl3N2O5S/c1-11-10-13(22)4-8-16(11)24-20(26)25-18-17(30-14-5-2-12(21)3-6-14)9-7-15(23)19(18)31(27,28)29/h2-10H,1H3,(H2,24,25,26)(H,27,28,29)
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n/an/a 3.36E+5n/an/an/an/an/an/a



Institut de Biologie Structurale Jean-Pierre Ebel (CEA/CNRS/UJF)

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2X preincubated for 1 hr before addition of substrate (R)-[2-(benzoylamino)propiony...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50385265
PNG
(CHEMBL2035293)
Show SMILES OB(O)CNC(=O)Cc1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C9H11BN2O5/c13-9(11-6-10(14)15)5-7-3-1-2-4-8(7)12(16)17/h1-4,14-15H,5-6H2,(H,11,13)
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n/an/a 3.39E+5n/an/an/an/an/an/a



Universit£ de Li£ge

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2x using S2d as substrate incubated for 60 mins prior to substrate addition by DTNB...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50385269
PNG
(CHEMBL2035301)
Show SMILES OB(O)CNC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C9H11BClNO3/c11-8-3-1-7(2-4-8)5-9(13)12-6-10(14)15/h1-4,14-15H,5-6H2,(H,12,13)
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n/an/a 3.76E+5n/an/an/an/an/an/a



Universit£ de Li£ge

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2x using S2d as substrate incubated for 60 mins prior to substrate addition by DTNB...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50385266
PNG
(CHEMBL2035295)
Show SMILES OB(O)CNC(=O)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C9H9BF3NO3/c11-9(12,13)7-4-2-1-3-6(7)8(15)14-5-10(16)17/h1-4,16-17H,5H2,(H,14,15)
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n/an/a 4.81E+5n/an/an/an/an/an/a



Universit£ de Li£ge

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2x using S2d as substrate incubated for 60 mins prior to substrate addition by DTNB...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50385264
PNG
(CHEMBL2035290)
Show SMILES OB(O)CNC(=O)Cc1ccccc1Cl
Show InChI InChI=1S/C9H11BClNO3/c11-8-4-2-1-3-7(8)5-9(13)12-6-10(14)15/h1-4,14-15H,5-6H2,(H,12,13)
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n/an/a 6.49E+5n/an/an/an/an/an/a



Universit£ de Li£ge

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2x using S2d as substrate incubated for 60 mins prior to substrate addition by DTNB...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50385262
PNG
(CHEMBL2035285)
Show SMILES OB(O)CNC(=O)c1c(F)cccc1F
Show InChI InChI=1S/C8H8BF2NO3/c10-5-2-1-3-6(11)7(5)8(13)12-4-9(14)15/h1-3,14-15H,4H2,(H,12,13)
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n/an/a 9.06E+5n/an/an/an/an/an/a



Universit£ de Li£ge

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2x using S2d as substrate incubated for 60 mins prior to substrate addition by DTNB...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2X


(Streptococcus pneumoniae R6)
BDBM50300687
PNG
(2-(5-((4-chlorophenylthio)methyl)-1,3,4-thiadiazol...)
Show SMILES Cc1ccc(Nc2nnc(CSc3ccc(Cl)cc3)s2)c(c1)S(O)(=O)=O
Show InChI InChI=1S/C16H14ClN3O3S3/c1-10-2-7-13(14(8-10)26(21,22)23)18-16-20-19-15(25-16)9-24-12-5-3-11(17)4-6-12/h2-8H,9H2,1H3,(H,18,20)(H,21,22,23)
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n/an/a>1.00E+6n/an/an/an/an/an/a



Institut de Biologie Structurale Jean-Pierre Ebel (CEA/CNRS/UJF)

Curated by ChEMBL


Assay Description
Inhibition of penicillin-sensitive Streptococcus pneumoniae R6 PBP2X preincubated for 1 hr before addition of substrate (R)-[2-(benzoylamino)propiony...


Citation and Details
More data for this
Ligand-Target Pair
Penicillin-binding protein 2x


(Streptococcus pneumoniae)
BDBM50300665
PNG
(5-boronothiophene-2-carboxylic acid | CHEMBL573906)
Show SMILES OB(O)c1ccc(s1)C(O)=O
Show InChI InChI=1S/C5H5BO4S/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2,9-10H,(H,7,8)
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n/an/a>1.00E+6n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Inhibition of penicillin-resistant Streptococcus pneumoniae 5204 PBP2X preincubated for 4 hrs before addition of substrate mixture of (R)-[2-(benzoyl...


Citation and Details
More data for this
Ligand-Target Pair