Found 28 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 |
Beta-lactamase
(Escherichia coli) | BDBM50167944
(3-(2-Piperidin-1-yl-phenylsulfamoyl)-thiophene-2-c...)Show InChI InChI=1S/C16H18N2O4S2/c19-16(20)15-14(8-11-23-15)24(21,22)17-12-6-2-3-7-13(12)18-9-4-1-5-10-18/h2-3,6-8,11,17H,1,4-5,9-10H2,(H,19,20) | PDB MMDB
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| Article PubMed
| 1.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Apparent inhibitory constant against beta-lactamase AmpC from Escherichia coli |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Beta-lactamase
(Escherichia coli) | BDBM50167950
(3-(4-Chloro-phenylsulfamoyl)-thiophene-2-carboxyli...)Show InChI InChI=1S/C11H8ClNO4S2/c12-7-1-3-8(4-2-7)13-19(16,17)9-5-6-18-10(9)11(14)15/h1-6,13H,(H,14,15) | PDB MMDB
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| MMDB PDB Article PubMed
| 2.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Apparent inhibitory constant against beta-lactamase AmpC from Escherichia coli |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Beta-lactamase
(Escherichia coli) | BDBM50167955
(2-Methyl-4-(toluene-4-sulfonylamino)-thiophene-3-c...)Show InChI InChI=1S/C13H13NO4S2/c1-8-3-5-10(6-4-8)20(17,18)14-11-7-19-9(2)12(11)13(15)16/h3-7,14H,1-2H3,(H,15,16) | PDB MMDB
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| Article PubMed
| 6.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Apparent inhibitory constant against beta-lactamase AmpC from Escherichia coli |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Beta-lactamase
(Escherichia coli) | BDBM50167947
(2,5-Dimethyl-4-(thiophen-2-ylsulfamoyl)-furan-3-ca...)Show InChI InChI=1S/C11H11NO5S2/c1-6-9(11(13)14)10(7(2)17-6)19(15,16)12-8-4-3-5-18-8/h3-5,12H,1-2H3,(H,13,14) | PDB MMDB
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| Article PubMed
| 6.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Apparent inhibitory constant against beta-lactamase AmpC from Escherichia coli |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Beta-lactamase
(Escherichia coli) | BDBM50167938
(3-(4-Sulfamoyl-phenylsulfamoyl)-thiophene-2-carbox...)Show SMILES NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccsc2C(O)=O)cc1 Show InChI InChI=1S/C11H10N2O6S3/c12-21(16,17)8-3-1-7(2-4-8)13-22(18,19)9-5-6-20-10(9)11(14)15/h1-6,13H,(H,14,15)(H2,12,16,17) | PDB MMDB
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| Article PubMed
| 9.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Apparent inhibitory constant against beta-lactamase AmpC from Escherichia coli |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Beta-lactamase
(Escherichia coli) | BDBM50167942
(3-(Benzothiazol-2-ylsulfanyl)-propane-1-sulfonic a...)Show InChI InChI=1S/C10H11NO3S3/c12-17(13,14)7-3-6-15-10-11-8-4-1-2-5-9(8)16-10/h1-2,4-5H,3,6-7H2,(H,12,13,14)/p-1 | PDB MMDB
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| 3.18E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Apparent inhibitory constant against beta-lactamase AmpC from Escherichia coli |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Beta-lactamase
(Escherichia coli) | BDBM50167956
(3-(Benzothiazol-2-ylsulfanyl)-propionic acid | CHE...)Show InChI InChI=1S/C10H9NO2S2/c12-9(13)5-6-14-10-11-7-3-1-2-4-8(7)15-10/h1-4H,5-6H2,(H,12,13) | PDB MMDB
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| Article PubMed
| 6.46E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Apparent inhibitory constant against beta-lactamase AmpC from Escherichia coli |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167941
(1H-indene | CHEMBL192812)Show InChI InChI=1S/C9H8/c1-2-5-9-7-3-6-8(9)4-1/h1-6H,7H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
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Patents
| Article PubMed
| n/a | n/a | n/a | 1.93E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167954
(CHEMBL195882 | isobutylbenzene)Show InChI InChI=1S/C10H14/c1-9(2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
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Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.90E+4 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50008558
(CHEMBL9113 | Toluen | Toluol | phenylmethane | tol...)Show InChI InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
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Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.02E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50094702
(1H-indole | CHEMBL15844 | Indol | Indole, 7 | indo...)Show InChI InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H | PDB MMDB
NCI pathway Reactome pathway KEGG
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Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 2.90E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50008567
(1,4-Dimethylbenzol | 1,4-xylene | 4-methyltoluene ...)Show InChI InChI=1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
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Similars
| PDB Article PubMed
| n/a | n/a | n/a | 4.22E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Endolysin [L99A,M102Q]
(Enterobacteria phage T4) | BDBM50167953
(3-Methyl-1H-pyrrole | 5-METHYLPYRROLE | CHEMBL4266...)Show InChI InChI=1S/C5H7N/c1-5-2-3-6-4-5/h2-4,6H,1H3 | PDB MMDB
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| PDB Article PubMed
| n/a | n/a | n/a | 1.59E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Endolysin [L99A,M102Q]
(Enterobacteria phage T4) | BDBM50008558
(CHEMBL9113 | Toluen | Toluol | phenylmethane | tol...)Show InChI InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 | PDB MMDB
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Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.56E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A/M102Q |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167948
(1-benzothiophene | 1-thiaindene | CHEMBL87112 | be...)Show InChI InChI=1S/C8H6S/c1-2-4-8-7(3-1)5-6-9-8/h1-6H | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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CHEMBL MCE PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | n/a | 7.40E+4 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167939
(3,4-DNH | 5-Hydroxy Tryptamine | BM 613 | Benzen |...) | PDB MMDB
NCI pathway Reactome pathway KEGG
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Patents
| Article PubMed
| n/a | n/a | n/a | 1.75E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167946
(1-Ethyl-3-methyl-benzene | CHEMBL31274)Show InChI InChI=1S/C9H12/c1-3-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
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CHEMBL MCE KEGG PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.98E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167943
(1-Ethyl-4-methyl-benzene | CHEMBL195384)Show InChI InChI=1S/C9H12/c1-3-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.20E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50008560
(1,2-Dimethylbenzol | 1,2-dimethylbenzene | 1,2-xyl...)Show InChI InChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 4.70E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167957
(CHEMBL195441 | butylbenzene)Show InChI InChI=1S/C10H14/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2-3,7H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
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Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.40E+4 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A,M102Q]
(Enterobacteria phage T4) | BDBM26187
(α-CA inhibitor, 11 | CHEMBL14060 | US9688816,...)Show InChI InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H | PDB MMDB
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Patents
Similars
| PDB Article PubMed
| n/a | n/a | n/a | 9.09E+4 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Endolysin [L99A,M102Q]
(Enterobacteria phage T4) | BDBM50167952
(3-chlorophenol | CHEMBL41172)Show InChI InChI=1S/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8H | PDB MMDB
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Patents
Similars
| PDB Article PubMed
| n/a | n/a | n/a | 5.60E+4 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167945
((3S)-3-amino-4-oxo-7-phenylheptanoic acid | CHEMBL...)Show InChI InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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CHEMBL MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.80E+4 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167940
(BENZOFURAN | CHEMBL363614)Show InChI InChI=1S/C8H6O/c1-2-4-8-7(3-1)5-6-9-8/h1-6H | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
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CHEMBL DrugBank KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 1.12E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167951
(Aethylbenzol | CHEMBL371561 | alpha-methyltoluene ...)Show InChI InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 6.80E+4 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A,M102Q]
(Enterobacteria phage T4) | BDBM50167958
(1-amino-2-fluorobenzene | 2-fluoroaniline | 2-fluo...)Show InChI InChI=1S/C6H6FN/c7-5-3-1-2-4-6(5)8/h1-4H,8H2 | PDB MMDB
KEGG
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CHEMBL DrugBank KEGG MMDB PC cid PC sid PDB UniChem
Patents
| PDB Article PubMed
| n/a | n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50008556
(1,3-Dimethylbenzol | 1,3-xylene | 3-xylene | CHEMB...)Show InChI InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL KEGG PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 3.64E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |
Endolysin [L99A]
(Enterobacteria phage T4) | BDBM50167949
(1,2-methylethylbenzene | 1-Ethyl-2-methylbenzene |...)Show InChI InChI=1S/C9H12/c1-3-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL KEGG PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | 5.05E+5 | n/a | n/a | n/a | n/a | n/a |
University of California San Francisco
Curated by ChEMBL
| Assay Description Dissociation constant against T4 lysozyme mutant L99A |
J Med Chem 48: 3714-28 (2005)
Article DOI: 10.1021/jm0491187 BindingDB Entry DOI: 10.7270/Q2VT1SW6 |
More data for this Ligand-Target Pair | |