Compile Data Set for Download or QSAR

Found 35 hits Enz. Inhib. hit(s) with all data for entry = 8319   

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
Aminopeptidase N (Sus scrofa (Pig))	BDBM240828 ((2R,3S)-3-amino-2-hydroxy-N-((S)-2-(hydroxyamino)-...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@H](C(=O)NO)c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C17H19N3O4/c18-13(11-7-3-1-4-8-11)15(21)17(23)19-14(16(22)20-24)12-9-5-2-6-10-12/h1-10,13-15,21,24H,18H2,(H,19,23)(H,20,22)/t13-,14-,15+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM23971 ((2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanami...) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(O)=O Show InChI InChI=1S/C16H24N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/t12-,13+,14+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	2.55E+3	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair				3D Structure (crystal)
Aminopeptidase N (Sus scrofa (Pig))	BDBM240829 ((2R,3S)-3-amino-2-hydroxy-N-((S)-1-(hydroxyamino)-...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NO)c1ccccc1 |r| Show InChI InChI=1S/C18H21N3O4/c19-15(13-9-5-2-6-10-13)16(22)18(24)20-14(17(23)21-25)11-12-7-3-1-4-8-12/h1-10,14-16,22,25H,11,19H2,(H,20,24)(H,21,23)/t14-,15-,16+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.40E+4	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240824 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C15H23N3O4/c1-9(2)8-11(14(20)18-22)17-15(21)13(19)12(16)10-6-4-3-5-7-10/h3-7,9,11-13,19,22H,8,16H2,1-2H3,(H,17,21)(H,18,20)/t11-,12-,13+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.67E+4	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240824 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C15H23N3O4/c1-9(2)8-11(14(20)18-22)17-15(21)13(19)12(16)10-6-4-3-5-7-10/h3-7,9,11-13,19,22H,8,16H2,1-2H3,(H,17,21)(H,18,20)/t11-,12-,13+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240825 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES CC(C)[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C14H21N3O4/c1-8(2)11(13(19)17-21)16-14(20)12(18)10(15)9-6-4-3-5-7-9/h3-8,10-12,18,21H,15H2,1-2H3,(H,16,20)(H,17,19)/t10-,11-,12+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.70E+4	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240827 ((2S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanam...) Show SMILES CCC(C)[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C15H23N3O4/c1-3-9(2)12(14(20)18-22)17-15(21)13(19)11(16)10-7-5-4-6-8-10/h4-9,11-13,19,22H,3,16H2,1-2H3,(H,17,21)(H,18,20)/t9?,11-,12-,13+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.29E+4	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240823 ((S)-2-((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpr...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C24H31N3O5/c1-15(2)13-19(24(31)32)27-22(29)18(14-16-9-5-3-6-10-16)26-23(30)21(28)20(25)17-11-7-4-8-12-17/h3-12,15,18-21,28H,13-14,25H2,1-2H3,(H,26,30)(H,27,29)(H,31,32)/t18-,19-,20-,21+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.05E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240825 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES CC(C)[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C14H21N3O4/c1-8(2)11(13(19)17-21)16-14(20)12(18)10(15)9-6-4-3-5-7-9/h3-8,10-12,18,21H,15H2,1-2H3,(H,16,20)(H,17,19)/t10-,11-,12+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.28E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240831 ((2R,3S)-3-amino-2-hydroxy-N-((S)-3-hydroxy-1-(hydr...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](CO)C(=O)NO)c1ccccc1 |r| Show InChI InChI=1S/C12H17N3O5/c13-9(7-4-2-1-3-5-7)10(17)12(19)14-8(6-16)11(18)15-20/h1-5,8-10,16-17,20H,6,13H2,(H,14,19)(H,15,18)/t8-,9-,10+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.58E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM23971 ((2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanami...) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(O)=O Show InChI InChI=1S/C16H24N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/t12-,13+,14+/m1/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.63E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240830 ((2R,3S)-3-amino-2-hydroxy-N-((S)-1-(hydroxyamino)-...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NO)c1ccccc1 |r| Show InChI InChI=1S/C18H21N3O5/c19-15(12-4-2-1-3-5-12)16(23)18(25)20-14(17(24)21-26)10-11-6-8-13(22)9-7-11/h1-9,14-16,22-23,26H,10,19H2,(H,20,25)(H,21,24)/t14-,15-,16+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.73E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240822 ((S)-2-((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpr...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)NC(C(O)=O)c1ccccc1 |r| Show InChI InChI=1S/C23H29N3O5/c1-14(2)13-17(21(28)26-19(23(30)31)16-11-7-4-8-12-16)25-22(29)20(27)18(24)15-9-5-3-6-10-15/h3-12,14,17-20,27H,13,24H2,1-2H3,(H,25,29)(H,26,28)(H,30,31)/t17-,18-,19?,20+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.86E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240816 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@H](C(O)=O)c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C17H18N2O4/c18-13(11-7-3-1-4-8-11)15(20)16(21)19-14(17(22)23)12-9-5-2-6-10-12/h1-10,13-15,20H,18H2,(H,19,21)(H,22,23)/t13-,14-,15+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.98E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240827 ((2S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanam...) Show SMILES CCC(C)[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C15H23N3O4/c1-3-9(2)12(14(20)18-22)17-15(21)13(19)11(16)10-7-5-4-6-8-10/h4-9,11-13,19,22H,3,16H2,1-2H3,(H,17,21)(H,18,20)/t9?,11-,12-,13+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.07E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240828 ((2R,3S)-3-amino-2-hydroxy-N-((S)-2-(hydroxyamino)-...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@H](C(=O)NO)c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C17H19N3O4/c18-13(11-7-3-1-4-8-11)15(21)17(23)19-14(16(22)20-24)12-9-5-2-6-10-12/h1-10,13-15,21,24H,18H2,(H,19,23)(H,20,22)/t13-,14-,15+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.13E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240812 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C15H22N2O4/c1-9(2)8-11(15(20)21)17-14(19)13(18)12(16)10-6-4-3-5-7-10/h3-7,9,11-13,18H,8,16H2,1-2H3,(H,17,19)(H,20,21)/t11-,12-,13+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.15E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240829 ((2R,3S)-3-amino-2-hydroxy-N-((S)-1-(hydroxyamino)-...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NO)c1ccccc1 |r| Show InChI InChI=1S/C18H21N3O4/c19-15(13-9-5-2-6-10-13)16(22)18(24)20-14(17(23)21-25)11-12-7-3-1-4-8-12/h1-10,14-16,22,25H,11,19H2,(H,20,24)(H,21,23)/t14-,15-,16+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.49E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240816 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@H](C(O)=O)c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C17H18N2O4/c18-13(11-7-3-1-4-8-11)15(20)16(21)19-14(17(22)23)12-9-5-2-6-10-12/h1-10,13-15,20H,18H2,(H,19,21)(H,22,23)/t13-,14-,15+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.54E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240815 ((2S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanam...) Show SMILES CCC(C)[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C15H22N2O4/c1-3-9(2)12(15(20)21)17-14(19)13(18)11(16)10-7-5-4-6-8-10/h4-9,11-13,18H,3,16H2,1-2H3,(H,17,19)(H,20,21)/t9?,11-,12-,13+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.64E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240814 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C12H16N2O4/c1-7(12(17)18)14-11(16)10(15)9(13)8-5-3-2-4-6-8/h2-7,9-10,15H,13H2,1H3,(H,14,16)(H,17,18)/t7-,9-,10+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.73E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240813 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES CC(C)[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C14H20N2O4/c1-8(2)11(14(19)20)16-13(18)12(17)10(15)9-6-4-3-5-7-9/h3-8,10-12,17H,15H2,1-2H3,(H,16,18)(H,19,20)/t10-,11-,12+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.87E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240826 ((2R,3S)-3-amino-2-hydroxy-N-((S)-1-(hydroxyamino)-...) Show SMILES C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C12H17N3O4/c1-7(11(17)15-19)14-12(18)10(16)9(13)8-5-3-2-4-6-8/h2-7,9-10,16,19H,13H2,1H3,(H,14,18)(H,15,17)/t7-,9-,10+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.92E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240831 ((2R,3S)-3-amino-2-hydroxy-N-((S)-3-hydroxy-1-(hydr...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](CO)C(=O)NO)c1ccccc1 |r| Show InChI InChI=1S/C12H17N3O5/c13-9(7-4-2-1-3-5-7)10(17)12(19)14-8(6-16)11(18)15-20/h1-5,8-10,16-17,20H,6,13H2,(H,14,19)(H,15,18)/t8-,9-,10+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.92E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240830 ((2R,3S)-3-amino-2-hydroxy-N-((S)-1-(hydroxyamino)-...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NO)c1ccccc1 |r| Show InChI InChI=1S/C18H21N3O5/c19-15(12-4-2-1-3-5-12)16(23)18(25)20-14(17(24)21-26)10-11-6-8-13(22)9-7-11/h1-9,14-16,22-23,26H,10,19H2,(H,20,25)(H,21,24)/t14-,15-,16+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.99E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240814 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C12H16N2O4/c1-7(12(17)18)14-11(16)10(15)9(13)8-5-3-2-4-6-8/h2-7,9-10,15H,13H2,1H3,(H,14,16)(H,17,18)/t7-,9-,10+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.42E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240812 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C15H22N2O4/c1-9(2)8-11(15(20)21)17-14(19)13(18)12(16)10-6-4-3-5-7-10/h3-7,9,11-13,18H,8,16H2,1-2H3,(H,17,19)(H,20,21)/t11-,12-,13+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.52E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240832 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)Nc1ccccc1C |r| Show InChI InChI=1S/C22H29N3O3/c1-14(2)13-18(21(27)24-17-12-8-7-9-15(17)3)25-22(28)20(26)19(23)16-10-5-4-6-11-16/h4-12,14,18-20,26H,13,23H2,1-3H3,(H,24,27)(H,25,28)/t18-,19-,20+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.63E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240818 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)c1ccccc1 |r| Show InChI InChI=1S/C18H20N2O5/c19-15(12-4-2-1-3-5-12)16(22)17(23)20-14(18(24)25)10-11-6-8-13(21)9-7-11/h1-9,14-16,21-22H,10,19H2,(H,20,23)(H,24,25)/t14-,15-,16+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.07E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240821 ((S)-2-((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpr...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C21H33N3O5/c1-12(2)10-15(19(26)24-16(21(28)29)11-13(3)4)23-20(27)18(25)17(22)14-8-6-5-7-9-14/h5-9,12-13,15-18,25H,10-11,22H2,1-4H3,(H,23,27)(H,24,26)(H,28,29)/t15-,16-,17-,18+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.24E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240817 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O)c1ccccc1 |r| Show InChI InChI=1S/C18H20N2O4/c19-15(13-9-5-2-6-10-13)16(21)17(22)20-14(18(23)24)11-12-7-3-1-4-8-12/h1-10,14-16,21H,11,19H2,(H,20,22)(H,23,24)/t14-,15-,16+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.97E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240821 ((S)-2-((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpr...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C21H33N3O5/c1-12(2)10-15(19(26)24-16(21(28)29)11-13(3)4)23-20(27)18(25)17(22)14-8-6-5-7-9-14/h5-9,12-13,15-18,25H,10-11,22H2,1-4H3,(H,23,27)(H,24,26)(H,28,29)/t15-,16-,17-,18+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.13E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240819 ((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpropanami...) Show SMILES N[C@H]([C@@H](O)C(=O)N[C@@H](CO)C(O)=O)c1ccccc1 |r| Show InChI InChI=1S/C12H16N2O5/c13-9(7-4-2-1-3-5-7)10(16)11(17)14-8(6-15)12(18)19/h1-5,8-10,15-16H,6,13H2,(H,14,17)(H,18,19)/t8-,9-,10+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.62E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM240820 ((S)-2-((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpr...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)N[C@@H](C(C)C)C(O)=O |r| Show InChI InChI=1S/C20H31N3O5/c1-11(2)10-14(18(25)23-16(12(3)4)20(27)28)22-19(26)17(24)15(21)13-8-6-5-7-9-13/h5-9,11-12,14-17,24H,10,21H2,1-4H3,(H,22,26)(H,23,25)(H,27,28)/t14-,15-,16-,17+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.90E+5	n/a	n/a	n/a	n/a	7.5	25
Shan Dong University					Assay Description IC50 values against APN from Porcine Kidney were determined by using L-Leu-p-nitroanilide as a substrate. All the solutions of the inhibitors were pr...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Sus scrofa (Pig))	BDBM240820 ((S)-2-((S)-2-((2R,3S)-3-amino-2-hydroxy-3-phenylpr...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](O)[C@@H](N)c1ccccc1)C(=O)N[C@@H](C(C)C)C(O)=O |r| Show InChI InChI=1S/C20H31N3O5/c1-11(2)10-14(18(25)23-16(12(3)4)20(27)28)22-19(26)17(24)15(21)13-8-6-5-7-9-13/h5-9,11-12,14-17,24H,10,21H2,1-4H3,(H,22,26)(H,23,25)(H,27,28)/t14-,15-,16-,17+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.90E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shan Dong University					Assay Description Gelatinase A (MMP-2) and TNBS were purchased from Sigma, and the substance was synthesized as described by Vijaykumar et al. The gelatinase, substanc...				J Enzyme Inhib Med Chem 28: 545-51 (2013) Article DOI: 10.3109/14756366.2012.656622 BindingDB Entry DOI: 10.7270/Q24J0D1S
					More data for this Ligand-Target Pair