Compile Data Set for Download or QSAR

Found 62 hits with Last Name = 'oelschlaeger' and Initial = 'p'   

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
Metallo-beta-lactamase type 2 (Bacillus cereus)	BDBM50174303 (CHEMBL3809419) Show SMILES OC(=O)[C@H](S)c1ccccc1 |r| Show InChI InChI=1S/C8H8O2S/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5,7,11H,(H,9,10)/t7-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Competitive inhibition of Bacillus cereus 569/H/9 metallo-beta-lactamase Bc2 expressed in Escherichia coli GI724 cells using nitrocefin as substrate ...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair				3D Structure (crystal)
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092976 (CHEMBL3586478) Show SMILES CSCC[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C13H17NO4S3/c1-19-6-4-10(13(18)21-8-12(16)17)14-11(15)7-9-3-2-5-20-9/h2-3,5,10H,4,6-8H2,1H3,(H,14,15)(H,16,17)/t10-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092980 (CHEMBL3586479) Show SMILES OC[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C11H13NO5S2/c13-5-8(11(17)19-6-10(15)16)12-9(14)4-7-2-1-3-18-7/h1-3,8,13H,4-6H2,(H,12,14)(H,15,16)/t8-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092982 (CHEMBL3585360) Show SMILES OC(=O)CSC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cccs1 |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092997 (CHEMBL3586481) Show SMILES OC(=O)CSC(=O)[C@H](CCCCNC(=O)Cc1cccs1)NC(=O)Cc1cccs1 |r| Show InChI InChI=1S/C20H24N2O5S3/c23-17(11-14-5-3-9-28-14)21-8-2-1-7-16(20(27)30-13-19(25)26)22-18(24)12-15-6-4-10-29-15/h3-6,9-10,16H,1-2,7-8,11-13H2,(H,21,23)(H,22,24)(H,25,26)/t16-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	190	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092979 (CHEMBL3586477) Show SMILES CC(C)C[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C14H19NO4S2/c1-9(2)6-11(14(19)21-8-13(17)18)15-12(16)7-10-4-3-5-20-10/h3-5,9,11H,6-8H2,1-2H3,(H,15,16)(H,17,18)/t11-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092977 (CHEMBL3586474) Show SMILES OC(=O)CSC(=O)CNC(=O)Cc1cccs1 Show InChI InChI=1S/C10H11NO4S2/c12-8(4-7-2-1-3-16-7)11-5-10(15)17-6-9(13)14/h1-3H,4-6H2,(H,11,12)(H,13,14)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	280	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092842 (CHEMBL3586476) Show SMILES CC(C)[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C16H18N2O2.C4H4O4/c19-16(12-3-4-12)13-5-7-15(8-6-13)20-9-1-2-14-10-17-11-18-14;5-3(6)1-2-4(7)8/h5-8,10-12H,1-4,9H2,(H,17,18);1-2H,(H,5,6)(H,7,8)/b;2-1-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	280	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092978 (CHEMBL3586475) Show SMILES C[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C11H13NO4S2/c1-7(11(16)18-6-10(14)15)12-9(13)5-8-3-2-4-17-8/h2-4,7H,5-6H2,1H3,(H,12,13)(H,14,15)/t7-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174181 (CHEMBL3809806) Show SMILES CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2N)cc1 Show InChI InChI=1S/C20H23N5OS/c1-2-3-6-14-9-11-15(12-10-14)22-18(26)13-27-20-23-19(24-25-20)16-7-4-5-8-17(16)21/h4-5,7-12H,2-3,6,13,21H2,1H3,(H,22,26)(H,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	490	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174175 (CHEMBL3808813) Show SMILES Oc1ccc(cc1)-c1nnc(SCC(=O)Nc2cccc(Cl)c2)[nH]1 Show InChI InChI=1S/C16H13ClN4O2S/c17-11-2-1-3-12(8-11)18-14(23)9-24-16-19-15(20-21-16)10-4-6-13(22)7-5-10/h1-8,22H,9H2,(H,18,23)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50093027 (CHEMBL3586482) Show SMILES OC(=O)CSC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1 |r| Show InChI InChI=1S/C35H46N4O9/c1-5-21(4)30(36-27(40)13-14-28(41)42)32(44)37-29(20(2)3)33(45)39-18-24(17-26(39)31(43)38-35(15-16-35)34(46)47)48-19-23-11-8-10-22-9-6-7-12-25(22)23/h6-12,20-21,24,26,29-30H,5,13-19H2,1-4H3,(H,36,40)(H,37,44)(H,38,43)(H,41,42)(H,46,47)/t21?,24-,26+,29+,30+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	870	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092981 (CHEMBL3586480) Show SMILES OC(=O)CSC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1cccs1 |r| Show InChI InChI=1S/C17H17NO4S2/c19-15(10-13-7-4-8-23-13)18-14(17(22)24-11-16(20)21)9-12-5-2-1-3-6-12/h1-8,14H,9-11H2,(H,18,19)(H,20,21)/t14-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	950	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089390 (CHEMBL3577963) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2nc3ccccc3s2)[nH]1 Show InChI InChI=1S/C18H13N5O3S2/c24-14(20-17-19-12-7-3-4-8-13(12)28-17)9-27-18-21-15(22-23-18)10-5-1-2-6-11(10)16(25)26/h1-8H,9H2,(H,25,26)(H,19,20,24)(H,21,22,23)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Bacillus cereus)	BDBM50174264 (CHEMBL3808751) Show SMILES OC(=O)[C@@H](S)c1ccccc1 |r| Show InChI InChI=1S/C8H8O2S/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5,7,11H,(H,9,10)/t7-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem	Article PubMed	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Competitive inhibition of Bacillus cereus 569/H/9 metallo-beta-lactamase Bc2 expressed in Escherichia coli GI724 cells using nitrocefin as substrate ...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089391 (CHEMBL3577964) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2ccc(Cl)cc2)[nH]1 Show InChI InChI=1S/C17H13ClN4O3S/c18-10-5-7-11(8-6-10)19-14(23)9-26-17-20-15(21-22-17)12-3-1-2-4-13(12)16(24)25/h1-8H,9H2,(H,19,23)(H,24,25)(H,20,21,22)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089388 (CHEMBL3577961) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2ccccc2)[nH]1 Show InChI InChI=1S/C17H14N4O3S/c22-14(18-11-6-2-1-3-7-11)10-25-17-19-15(20-21-17)12-8-4-5-9-13(12)16(23)24/h1-9H,10H2,(H,18,22)(H,23,24)(H,19,20,21)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089393 (CHEMBL3577970) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2cccc(c2)[N+]([O-])=O)[nH]1 Show InChI InChI=1S/C17H13N5O5S/c23-14(18-10-4-3-5-11(8-10)22(26)27)9-28-17-19-15(20-21-17)12-6-1-2-7-13(12)16(24)25/h1-8H,9H2,(H,18,23)(H,24,25)(H,19,20,21)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089392 (CHEMBL3577965) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2ccc(cc2)[N+]([O-])=O)[nH]1 Show InChI InChI=1S/C17H13N5O5S/c23-14(18-10-5-7-11(8-6-10)22(26)27)9-28-17-19-15(20-21-17)12-3-1-2-4-13(12)16(24)25/h1-8H,9H2,(H,18,23)(H,24,25)(H,19,20,21)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089385 (CHEMBL3577967) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2ccccc2Cl)[nH]1 Show InChI InChI=1S/C17H13ClN4O3S/c18-12-7-3-4-8-13(12)19-14(23)9-26-17-20-15(21-22-17)10-5-1-2-6-11(10)16(24)25/h1-8H,9H2,(H,19,23)(H,24,25)(H,20,21,22)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089386 (CHEMBL3577968) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2cccc(Cl)c2)[nH]1 Show InChI InChI=1S/C17H13ClN4O3S/c18-10-4-3-5-11(8-10)19-14(23)9-26-17-20-15(21-22-17)12-6-1-2-7-13(12)16(24)25/h1-8H,9H2,(H,19,23)(H,24,25)(H,20,21,22)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089387 (CHEMBL3577969) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2ccccc2[N+]([O-])=O)[nH]1 Show InChI InChI=1S/C17H13N5O5S/c23-14(18-12-7-3-4-8-13(12)22(26)27)9-28-17-19-15(20-21-17)10-5-1-2-6-11(10)16(24)25/h1-8H,9H2,(H,18,23)(H,24,25)(H,19,20,21)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089389 (CHEMBL3577962) Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2nc3ccccc3[nH]2)[nH]1 Show InChI InChI=1S/C18H14N6O3S/c25-14(21-17-19-12-7-3-4-8-13(12)20-17)9-28-18-22-15(23-24-18)10-5-1-2-6-11(10)16(26)27/h1-8H,9H2,(H,26,27)(H,22,23,24)(H2,19,20,21,25)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089395 (CHEMBL3577972) Show SMILES OC(=O)CCc1nnc(SCC(=O)Nc2nc3ccccc3[nH]2)[nH]1 Show InChI InChI=1S/C14H14N6O3S/c21-11(18-13-15-8-3-1-2-4-9(8)16-13)7-24-14-17-10(19-20-14)5-6-12(22)23/h1-4H,5-7H2,(H,22,23)(H,17,19,20)(H2,15,16,18,21)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.50E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089396 (CHEMBL3577974) Show SMILES OC(=O)CCc1nnc(SCC(=O)Nc2ccc(Cl)cc2)[nH]1 Show InChI InChI=1S/C13H13ClN4O3S/c14-8-1-3-9(4-2-8)15-11(19)7-22-13-16-10(17-18-13)5-6-12(20)21/h1-4H,5-7H2,(H,15,19)(H,20,21)(H,16,17,18)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Beta-lactamase (Aeromonas veronii)	BDBM50089394 (CHEMBL3577971) Show SMILES OC(=O)CCc1nnc(SCC(=O)Nc2ccccc2)[nH]1 Show InChI InChI=1S/C13H14N4O3S/c18-11(14-9-4-2-1-3-5-9)8-21-13-15-10(16-17-13)6-7-12(19)20/h1-5H,6-8H2,(H,14,18)(H,19,20)(H,15,16,17)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...				ACS Med Chem Lett 6: 455-60 (2015) Article DOI: 10.1021/ml500534c BindingDB Entry DOI: 10.7270/Q2XP76P0
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092976 (CHEMBL3586478) Show SMILES CSCC[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C13H17NO4S3/c1-19-6-4-10(13(18)21-8-12(16)17)14-11(15)7-9-3-2-5-20-9/h2-3,5,10H,4,6-8H2,1H3,(H,14,15)(H,16,17)/t10-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mins prior to...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092979 (CHEMBL3586477) Show SMILES CC(C)C[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C14H19NO4S2/c1-9(2)6-11(14(19)21-8-13(17)18)15-12(16)7-10-4-3-5-20-10/h3-5,9,11H,6-8H2,1-2H3,(H,15,16)(H,17,18)/t11-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	69	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mins prior to...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174227 (CHEMBL3810052) Show SMILES CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2)cc1 Show InChI InChI=1S/C20H22N4OS/c1-2-3-7-15-10-12-17(13-11-15)21-18(25)14-26-20-22-19(23-24-20)16-8-5-4-6-9-16/h4-6,8-13H,2-3,7,14H2,1H3,(H,21,25)(H,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174186 (CHEMBL3808671) Show SMILES CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2O)cc1 Show InChI InChI=1S/C20H22N4O2S/c1-2-3-6-14-9-11-15(12-10-14)21-18(26)13-27-20-22-19(23-24-20)16-7-4-5-8-17(16)25/h4-5,7-12,25H,2-3,6,13H2,1H3,(H,21,26)(H,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174182 (CHEMBL3809576) Show SMILES Oc1ccccc1-c1nnc(SCC(=O)Nc2cccc(Cl)c2)[nH]1 Show InChI InChI=1S/C16H13ClN4O2S/c17-10-4-3-5-11(8-10)18-14(23)9-24-16-19-15(20-21-16)12-6-1-2-7-13(12)22/h1-8,22H,9H2,(H,18,23)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174181 (CHEMBL3809806) Show SMILES CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2N)cc1 Show InChI InChI=1S/C20H23N5OS/c1-2-3-6-14-9-11-15(12-10-14)22-18(26)13-27-20-23-19(24-25-20)16-7-4-5-8-17(16)21/h4-5,7-12H,2-3,6,13,21H2,1H3,(H,22,26)(H,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells preincubated for 60 min followed by ad...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174191 (CHEMBL3809719) Show SMILES Cc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1O Show InChI InChI=1S/C17H16N4O2S/c1-11-6-2-4-8-13(11)18-15(23)10-24-17-19-16(20-21-17)12-7-3-5-9-14(12)22/h2-9,22H,10H2,1H3,(H,18,23)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174230 (CHEMBL3809713) Show SMILES O=C(CSc1nnc([nH]1)-c1ccccc1)Nc1ccccc1 Show InChI InChI=1S/C16H14N4OS/c21-14(17-13-9-5-2-6-10-13)11-22-16-18-15(19-20-16)12-7-3-1-4-8-12/h1-10H,11H2,(H,17,21)(H,18,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174229 (CHEMBL3808678) Show SMILES Cc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1 Show InChI InChI=1S/C17H16N4OS/c1-12-7-5-6-10-14(12)18-15(22)11-23-17-19-16(20-21-17)13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,18,22)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174312 (CHEMBL3809860) Show SMILES Nc1ccccc1-c1nnc(SCC(=O)Nc2cccc(Cl)c2)[nH]1 Show InChI InChI=1S/C16H14ClN5OS/c17-10-4-3-5-11(8-10)19-14(23)9-24-16-20-15(21-22-16)12-6-1-2-7-13(12)18/h1-8H,9,18H2,(H,19,23)(H,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells preincubated for 60 min followed by ad...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092982 (CHEMBL3585360) Show SMILES OC(=O)CSC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cccs1 |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mins prior to...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174311 (CHEMBL3808891) Show SMILES Nc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2)[nH]1 Show InChI InChI=1S/C16H15N5OS/c17-13-9-5-4-8-12(13)15-19-16(21-20-15)23-10-14(22)18-11-6-2-1-3-7-11/h1-9H,10,17H2,(H,18,22)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells preincubated for 60 min followed by ad...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174195 (CHEMBL3809469) Show SMILES Clc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1 Show InChI InChI=1S/C16H13ClN4OS/c17-12-8-4-5-9-13(12)18-14(22)10-23-16-19-15(20-21-16)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,22)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174175 (CHEMBL3808813) Show SMILES Oc1ccc(cc1)-c1nnc(SCC(=O)Nc2cccc(Cl)c2)[nH]1 Show InChI InChI=1S/C16H13ClN4O2S/c17-11-2-1-3-12(8-11)18-14(23)9-24-16-19-15(20-21-16)10-4-6-13(22)7-5-10/h1-8,22H,9H2,(H,18,23)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells preincubated for 60 min followed by ad...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174192 (CHEMBL3809609) Show SMILES Oc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2)[nH]1 Show InChI InChI=1S/C16H14N4O2S/c21-13-9-5-4-8-12(13)15-18-16(20-19-15)23-10-14(22)17-11-6-2-1-3-7-11/h1-9,21H,10H2,(H,17,22)(H,18,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174309 (CHEMBL3810122) Show SMILES CCc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1N Show InChI InChI=1S/C18H19N5OS/c1-2-12-7-3-6-10-15(12)20-16(24)11-25-18-21-17(22-23-18)13-8-4-5-9-14(13)19/h3-10H,2,11,19H2,1H3,(H,20,24)(H,21,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells preincubated for 60 min followed by ad...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50093027 (CHEMBL3586482) Show SMILES OC(=O)CSC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1 |r| Show InChI InChI=1S/C35H46N4O9/c1-5-21(4)30(36-27(40)13-14-28(41)42)32(44)37-29(20(2)3)33(45)39-18-24(17-26(39)31(43)38-35(15-16-35)34(46)47)48-19-23-11-8-10-22-9-6-7-12-25(22)23/h6-12,20-21,24,26,29-30H,5,13-19H2,1-4H3,(H,36,40)(H,37,44)(H,38,43)(H,41,42)(H,46,47)/t21?,24-,26+,29+,30+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mins prior to...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092842 (CHEMBL3586476) Show SMILES CC(C)[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C16H18N2O2.C4H4O4/c19-16(12-3-4-12)13-5-7-15(8-6-13)20-9-1-2-14-10-17-11-18-14;5-3(6)1-2-4(7)8/h5-8,10-12H,1-4,9H2,(H,17,18);1-2H,(H,5,6)(H,7,8)/b;2-1-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mins prior to...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174306 (CHEMBL3808797) Show SMILES CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C20H22N4O2S/c1-2-3-4-14-5-9-16(10-6-14)21-18(26)13-27-20-22-19(23-24-20)15-7-11-17(25)12-8-15/h5-12,25H,2-4,13H2,1H3,(H,21,26)(H,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells preincubated for 60 min followed by ad...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174305 (CHEMBL3810235) Show SMILES Oc1ccc(cc1)-c1nnc(SCC(=O)Nc2ccccc2Cl)[nH]1 Show InChI InChI=1S/C16H13ClN4O2S/c17-12-3-1-2-4-13(12)18-14(23)9-24-16-19-15(20-21-16)10-5-7-11(22)8-6-10/h1-8,22H,9H2,(H,18,23)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells preincubated for 60 min followed by ad...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174314 (CHEMBL3809238) Show SMILES Nc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2Cl)[nH]1 Show InChI InChI=1S/C16H14ClN5OS/c17-11-6-2-4-8-13(11)19-14(23)9-24-16-20-15(21-22-16)10-5-1-3-7-12(10)18/h1-8H,9,18H2,(H,19,23)(H,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells preincubated for 60 min followed by ad...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase type 2 (Klebsiella pneumoniae)	BDBM50174194 (CHEMBL3810164) Show SMILES Clc1cccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2)c1 Show InChI InChI=1S/C16H13ClN4OS/c17-12-7-4-8-13(9-12)18-14(22)10-23-16-19-15(20-21-16)11-5-2-1-3-6-11/h1-9H,10H2,(H,18,22)(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	690	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Mixed type inhibition of Klebsiella pneumoniae metallo-beta-lactamase NDM-1 expressed in Escherichia coli BL21(DE3) cells assessed as hydrolysis of c...				ACS Med Chem Lett 7: 413-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00495 BindingDB Entry DOI: 10.7270/Q2GQ70PT
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092977 (CHEMBL3586474) Show SMILES OC(=O)CSC(=O)CNC(=O)Cc1cccs1 Show InChI InChI=1S/C10H11NO4S2/c12-8(4-7-2-1-3-16-7)11-5-10(15)17-6-9(13)14/h1-3H,4-6H2,(H,11,12)(H,13,14)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mins prior to...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair
Metallo-beta-lactamase L1 type 3 (Stenotrophomonas maltophilia)	BDBM50092978 (CHEMBL3586475) Show SMILES C[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r| Show InChI InChI=1S/C11H13NO4S2/c1-7(11(16)18-6-10(14)15)12-9(13)5-8-3-2-4-17-8/h2-4,7H,5-6H2,1H3,(H,12,13)(H,14,15)/t7-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
Northwest University Curated by ChEMBL					Assay Description Inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mins prior to...				ACS Med Chem Lett 6: 660-4 (2015) Article DOI: 10.1021/acsmedchemlett.5b00098 BindingDB Entry DOI: 10.7270/Q2M04769
					More data for this Ligand-Target Pair

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