TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T38179 Staphylococcus Beta-lactamase B5QW2S 2-Methylene-3-methyl-4-(sodiooxycarbonyl)-7-[(Z)-2-oxo-2-(sodiooxy)ethylidene]cepham-3-ene 1,1-dioxide Investigative 44381013 C11H7NNa2O7S 343.22 CC1=C(N2[C@@H](/C(=C\\C(=O)[O-])/C2=O)S(=O)(=O)C1=C)C(=O)[O-].[Na+].[Na+] IC50 = 277000 nM Non binder T38179 Staphylococcus Beta-lactamase B6WKN1 Sodium;(2S,3R,6Z)-3-(chloromethyl)-6-(2-methoxy-2-oxoethylidene)-3-methyl-4,4,7-trioxo-4lambda6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Investigative 44303012 C11H11ClNNaO7S 359.72 C[C@@]1([C@@H](N2C(S1(=O)=O)/C(=C\\C(=O)OC)/C2=O)C(=O)[O-])CCl.[Na+] IC50 = 432000 nM Non binder T38179 Staphylococcus Beta-lactamase BFW4A1 [3-(Acetyloxymethyl)-7-[(Z)-2-pyridylmethylene]cepham-3-ene-4-carboxylic acid sodium]1,1-dioxide salt Investigative 44265260 C16H13N2NaO7S 400.3 CC(=O)OCC1=C(N2[C@@H](/C(=C\\C3=CC=CC=N3)/C2=O)S(=O)(=O)C1)C(=O)[O-].[Na+] IC50 = 402000 nM Non binder T38179 Staphylococcus Beta-lactamase BMB41R Sodium;(2S,3R,6Z)-6-(2-methoxy-2-oxoethylidene)-3-methyl-3-[[2-(1-methyltetrazol-5-yl)sulfanylacetyl]oxymethyl]-4,4,7-trioxo-4lambda6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Investigative 44303347 C15H16N5NaO9S2 497.4 C[C@@]1([C@@H](N2C(S1(=O)=O)/C(=C\\C(=O)OC)/C2=O)C(=O)[O-])COC(=O)CSC3=NN=NN3C.[Na+] IC50 = 939700 nM Non binder T38179 Staphylococcus Beta-lactamase BNJ35X Sodium;(4S,6R,7Z)-3-methyl-4-(1-methyltetrazol-5-yl)sulfanyl-5,5,8-trioxo-7-(pyridin-2-ylmethylidene)-5lambda6-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Investigative 44381110 C16H13N6NaO5S2 456.4 CC1=C(N2[C@@H](/C(=C\\C3=CC=CC=N3)/C2=O)S(=O)(=O)[C@@H]1SC4=NN=NN4C)C(=O)[O-].[Na+] IC50 = 844000 nM Non binder T38179 Staphylococcus Beta-lactamase BQ2E7J Sodium;(7Z)-3-cyano-5,5,8-trioxo-7-(pyridin-2-ylmethylidene)-5lambda6-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Investigative 44381784 C14H8N3NaO5S 353.29 C1C(=C(N2C(S1(=O)=O)/C(=C\\C3=CC=CC=N3)/C2=O)C(=O)[O-])C#N.[Na+] IC50 = 280000 nM Non binder T38179 Staphylococcus Beta-lactamase BRZQ31 [3-(Acetyloxymethyl)-7-[(Z)-tert-butoxycarbonylmethylene]cepham-3-ene-4-carboxylic acid sodium]1,1-dioxide salt Investigative 23714228 C16H18NNaO9S 423.4 CC(=O)OCC1=C(N2[C@@H](/C(=C\\C(=O)OC(C)(C)C)/C2=O)S(=O)(=O)C1)C(=O)[O-].[Na+] IC50 = 977000 nM Non binder T38179 Staphylococcus Beta-lactamase BSR76L Disodium;(2S,3S,6Z)-6-(carboxylatomethylidene)-3-[(E)-2-cyanoethenyl]-3-methyl-4,4,7-trioxo-4lambda6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Investigative 44302994 C12H8N2Na2O7S 370.25 C[C@@]1([C@@H](N2C(S1(=O)=O)/C(=C\\C(=O)[O-])/C2=O)C(=O)[O-])/C=C/C#N.[Na+].[Na+] IC50 = 504000 nM Non binder T38179 Staphylococcus Beta-lactamase BZ10XN Sodium;(7Z)-3-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]-5,5,8-trioxo-7-(pyridin-2-ylmethylidene)-5lambda6-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Investigative 44381483 C20H19N2NaO7S 454.4 CC(C)(C)OC(=O)/C=C/C1=C(N2C(/C(=C\\C3=CC=CC=N3)/C2=O)S(=O)(=O)C1)C(=O)[O-].[Na+] IC50 = 240000 nM Non binder T38179 Staphylococcus Beta-lactamase BZ6L5C Disodium;(2S,3R,6Z)-6-(carboxylatomethylidene)-3-methyl-4,4,7-trioxo-3-[(2-phenylacetyl)oxymethyl]-4lambda6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Investigative 44303046 C18H15NNa2O9S 467.4 C[C@@]1([C@@H](N2C(S1(=O)=O)/C(=C\\C(=O)[O-])/C2=O)C(=O)[O-])COC(=O)CC3=CC=CC=C3.[Na+].[Na+] IC50 = 579000 nM Non binder T38179 Staphylococcus Beta-lactamase BZQ9P6 2-Methylene-3-(acetoxymethyl)-4-(sodiooxycarbonyl)-7-[(Z)-2-oxo-2-(sodiooxy)ethylidene]cepham-3-ene 1,1-dioxide Investigative 44381030 C13H9NNa2O9S 401.26 CC(=O)OCC1=C(N2[C@@H](/C(=C\\C(=O)[O-])/C2=O)S(=O)(=O)C1=C)C(=O)[O-].[Na+].[Na+] IC50 = 230000 nM Non binder