Compile Data Set for Download or QSAR

Found 54 hits of ic50 for UniProtKB: P17538   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50073139 (2-(4-cyanophenylcarboxamido)-1,1-dimethyl-4-phenyl...) Show SMILES CC(C)(C(CCc1ccccc1)NC(=O)c1ccc(cc1)C#N)C(=O)OC(=O)C(C)(C)C(CCc1ccccc1)NC(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C42H42N4O5/c1-41(2,35(25-19-29-11-7-5-8-12-29)45-37(47)33-21-15-31(27-43)16-22-33)39(49)51-40(50)42(3,4)36(26-20-30-13-9-6-10-14-30)46-38(48)34-23-17-32(28-44)18-24-34/h5-18,21-24,35-36H,19-20,25-26H2,1-4H3,(H,45,47)(H,46,48)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075109 (1,1-dimethyl-2-phenylcarboxamidoheptanoic anhydrid...) Show SMILES CCCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCC)NC(=O)c1ccccc1 Show InChI InChI=1S/C32H44N2O5/c1-7-9-21-25(33-27(35)23-17-13-11-14-18-23)31(3,4)29(37)39-30(38)32(5,6)26(22-10-8-2)34-28(36)24-19-15-12-16-20-24/h11-20,25-26H,7-10,21-22H2,1-6H3,(H,33,35)(H,34,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50142284 (2-Ethyl-1,1-dioxo-1,2,3,4,6,7-hexahydro-5,8-dioxa-...) Show SMILES CCCCNC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)C1Cc2cc3OCCOc3cc2S(=O)(=O)N1CC Show InChI InChI=1S/C27H33N3O7S/c1-3-5-11-28-27(33)25(31)20(14-18-9-7-6-8-10-18)29-26(32)21-15-19-16-22-23(37-13-12-36-22)17-24(19)38(34,35)30(21)4-2/h6-10,16-17,20-21H,3-5,11-15H2,1-2H3,(H,28,33)(H,29,32)/t20-,21?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>10	n/a	n/a	n/a	n/a	n/a	n/a
Cephalon, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human calpain 1 in Molt-4 cells (intact human T-cell leukemia cell line)				Bioorg Med Chem Lett 14: 1035-8 (2004) Article DOI: 10.1016/j.bmcl.2003.11.037 BindingDB Entry DOI: 10.7270/Q27H1K45
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075107 (1,1-dimethyl-4-phenyl-2-propylcarboxamidopentanoic...) Show SMILES CCCC(=O)NC(CCc1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCc1ccccc1)NC(=O)CCC Show InChI InChI=1S/C34H48N2O5/c1-7-15-29(37)35-27(23-21-25-17-11-9-12-18-25)33(3,4)31(39)41-32(40)34(5,6)28(36-30(38)16-8-2)24-22-26-19-13-10-14-20-26/h9-14,17-20,27-28H,7-8,15-16,21-24H2,1-6H3,(H,35,37)(H,36,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075107 (1,1-dimethyl-4-phenyl-2-propylcarboxamidopentanoic...) Show SMILES CCCC(=O)NC(CCc1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCc1ccccc1)NC(=O)CCC Show InChI InChI=1S/C34H48N2O5/c1-7-15-29(37)35-27(23-21-25-17-11-9-12-18-25)33(3,4)31(39)41-32(40)34(5,6)28(36-30(38)16-8-2)24-22-26-19-13-10-14-20-26/h9-14,17-20,27-28H,7-8,15-16,21-24H2,1-6H3,(H,35,37)(H,36,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075110 (2-(4-cyanophenylcarboxamido)-1,1-dimethyl-2-phenyl...) Show SMILES CC(C)(C(NC(=O)c1ccc(cc1)C#N)c1ccccc1)C(=O)OC(=O)C(C)(C)C(NC(=O)c1ccc(cc1)C#N)c1ccccc1 Show InChI InChI=1S/C38H34N4O5/c1-37(2,31(27-11-7-5-8-12-27)41-33(43)29-19-15-25(23-39)16-20-29)35(45)47-36(46)38(3,4)32(28-13-9-6-10-14-28)42-34(44)30-21-17-26(24-40)18-22-30/h5-22,31-32H,1-4H3,(H,41,43)(H,42,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against porcine pancreatic trypsin (TRP)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075106 (1,1-dimethyl-4-phenyl-2-phenylcarboxamidopentanoic...) Show SMILES CC(C)(C(CCc1ccccc1)NC(=O)c1ccccc1)C(=O)OC(=O)C(C)(C)C(CCc1ccccc1)NC(=O)c1ccccc1 Show InChI InChI=1S/C40H44N2O5/c1-39(2,33(27-25-29-17-9-5-10-18-29)41-35(43)31-21-13-7-14-22-31)37(45)47-38(46)40(3,4)34(28-26-30-19-11-6-12-20-30)42-36(44)32-23-15-8-16-24-32/h5-24,33-34H,25-28H2,1-4H3,(H,41,43)(H,42,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075106 (1,1-dimethyl-4-phenyl-2-phenylcarboxamidopentanoic...) Show SMILES CC(C)(C(CCc1ccccc1)NC(=O)c1ccccc1)C(=O)OC(=O)C(C)(C)C(CCc1ccccc1)NC(=O)c1ccccc1 Show InChI InChI=1S/C40H44N2O5/c1-39(2,33(27-25-29-17-9-5-10-18-29)41-35(43)31-21-13-7-14-22-31)37(45)47-38(46)40(3,4)34(28-26-30-19-11-6-12-20-30)42-36(44)32-23-15-8-16-24-32/h5-24,33-34H,25-28H2,1-4H3,(H,41,43)(H,42,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against porcine pancreatic trypsin (TRP)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075114 (1,1-dimethyl-2-phenylcarboxamidooctanoic anhydride...) Show SMILES CCCCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCCC)NC(=O)c1ccccc1 Show InChI InChI=1S/C34H48N2O5/c1-7-9-13-23-27(35-29(37)25-19-15-11-16-20-25)33(3,4)31(39)41-32(40)34(5,6)28(24-14-10-8-2)36-30(38)26-21-17-12-18-22-26/h11-12,15-22,27-28H,7-10,13-14,23-24H2,1-6H3,(H,35,37)(H,36,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against human leukocyte cathepsin G (h-CG)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075104 (1,1-dimethyl-2-phenylcarboxamidononanoic anhydride...) Show SMILES CCCCCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCCCC)NC(=O)c1ccccc1 Show InChI InChI=1S/C36H52N2O5/c1-7-9-11-19-25-29(37-31(39)27-21-15-13-16-22-27)35(3,4)33(41)43-34(42)36(5,6)30(26-20-12-10-8-2)38-32(40)28-23-17-14-18-24-28/h13-18,21-24,29-30H,7-12,19-20,25-26H2,1-6H3,(H,37,39)(H,38,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against porcine pancreatic elastase (PPE)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075118 (1,1-dimethyl-2-phenylcarboxamidohexanoic anhydride...) Show SMILES CCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCC)NC(=O)c1ccccc1 Show InChI InChI=1S/C30H40N2O5/c1-7-15-23(31-25(33)21-17-11-9-12-18-21)29(3,4)27(35)37-28(36)30(5,6)24(16-8-2)32-26(34)22-19-13-10-14-20-22/h9-14,17-20,23-24H,7-8,15-16H2,1-6H3,(H,31,33)(H,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50289952 (6-Dimethylamino-5-methyl-2-(1-phenyl-ethylamino)-b...) Show SMILES C[C@@H](Nc1nc2ccc(N(C)C)c(C)c2c(=O)o1)c1ccccc1 Show InChI InChI=1S/C19H21N3O2/c1-12-16(22(3)4)11-10-15-17(12)18(23)24-19(21-15)20-13(2)14-8-6-5-7-9-14/h5-11,13H,1-4H3,(H,20,21)/t13-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against human chymotrypsin				Bioorg Med Chem Lett 7: 2105-2108 (1997) Article DOI: 10.1016/S0960-894X(97)00368-5 BindingDB Entry DOI: 10.7270/Q2RR1Z6P
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075105 (1,1-dimethyl-2-phenylcarboxamidopentanoic anhydrid...) Show SMILES CCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CC)NC(=O)c1ccccc1 Show InChI InChI=1S/C28H36N2O5/c1-7-21(29-23(31)19-15-11-9-12-16-19)27(3,4)25(33)35-26(34)28(5,6)22(8-2)30-24(32)20-17-13-10-14-18-20/h9-18,21-22H,7-8H2,1-6H3,(H,29,31)(H,30,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50289954 (5-Methyl-2-(1-phenyl-ethylamino)-benzo[d][1,3]oxaz...) Show SMILES C[C@@H](Nc1nc2cccc(C)c2c(=O)o1)c1ccccc1 Show InChI InChI=1S/C17H16N2O2/c1-11-7-6-10-14-15(11)16(20)21-17(19-14)18-12(2)13-8-4-3-5-9-13/h3-10,12H,1-2H3,(H,18,19)/t12-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against human chymotrypsin				Bioorg Med Chem Lett 7: 2105-2108 (1997) Article DOI: 10.1016/S0960-894X(97)00368-5 BindingDB Entry DOI: 10.7270/Q2RR1Z6P
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075113 (1,1-dimethyl-2-phenylcarboxamidopropanoic anhydrid...) Show SMILES CC(C)(CNC(=O)c1ccccc1)C(=O)OC(=O)C(C)(C)CNC(=O)c1ccccc1 Show InChI InChI=1S/C24H28N2O5/c1-23(2,15-25-19(27)17-11-7-5-8-12-17)21(29)31-22(30)24(3,4)16-26-20(28)18-13-9-6-10-14-18/h5-14H,15-16H2,1-4H3,(H,25,27)(H,26,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50289953 (2-[1-(4-Bromo-phenyl)-ethylamino]-5-methyl-benzo[d...) Show SMILES C[C@@H](Nc1nc2cccc(C)c2c(=O)o1)c1ccc(Br)cc1 Show InChI InChI=1S/C17H15BrN2O2/c1-10-4-3-5-14-15(10)16(21)22-17(20-14)19-11(2)12-6-8-13(18)9-7-12/h3-9,11H,1-2H3,(H,19,20)/t11-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against human chymotrypsin				Bioorg Med Chem Lett 7: 2105-2108 (1997) Article DOI: 10.1016/S0960-894X(97)00368-5 BindingDB Entry DOI: 10.7270/Q2RR1Z6P
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50289955 (5-Methyl-2-(1-phenyl-ethylamino)-benzo[d][1,3]oxaz...) Show SMILES C[C@H](Nc1nc2cccc(C)c2c(=O)o1)c1ccccc1 Show InChI InChI=1S/C17H16N2O2/c1-11-7-6-10-14-15(11)16(20)21-17(19-14)18-12(2)13-8-4-3-5-9-13/h3-10,12H,1-2H3,(H,18,19)/t12-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against human chymotrypsin				Bioorg Med Chem Lett 7: 2105-2108 (1997) Article DOI: 10.1016/S0960-894X(97)00368-5 BindingDB Entry DOI: 10.7270/Q2RR1Z6P
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075116 (2-(4-cyanophenylcarboxamido)-1,1-dimethyl-2-(2-met...) Show SMILES Cc1ccccc1C(NC(=O)c1ccc(cc1)C#N)C(C)(C)C(=O)OC(=O)C(C)(C)C(NC(=O)c1ccc(cc1)C#N)c1ccccc1C Show InChI InChI=1S/C40H38N4O5/c1-25-11-7-9-13-31(25)33(43-35(45)29-19-15-27(23-41)16-20-29)39(3,4)37(47)49-38(48)40(5,6)34(32-14-10-8-12-26(32)2)44-36(46)30-21-17-28(24-42)18-22-30/h7-22,33-34H,1-6H3,(H,43,45)(H,44,46)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against human chymase (h-chymase)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075111 (2-(4-cyanophenylcarboxamido)-2-cyclohex-3-enyl-1,1...) Show SMILES CC(C)(C(NC(=O)c1ccc(cc1)C#N)C1CCC=CC1)C(=O)OC(=O)C(C)(C)C(NC(=O)c1ccc(cc1)C#N)C1CCC=CC1 |c:19,47| Show InChI InChI=1S/C38H42N4O5/c1-37(2,31(27-11-7-5-8-12-27)41-33(43)29-19-15-25(23-39)16-20-29)35(45)47-36(46)38(3,4)32(28-13-9-6-10-14-28)42-34(44)30-21-17-26(24-40)18-22-30/h5-7,9,15-22,27-28,31-32H,8,10-14H2,1-4H3,(H,41,43)(H,42,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075108 (2-(2-chlorophenyl)-2-(4-cyanophenylcarboxamido)-1,...) Show SMILES CC(C)(C(NC(=O)c1ccc(cc1)C#N)c1ccccc1Cl)C(=O)OC(=O)C(C)(C)C(NC(=O)c1ccc(cc1)C#N)c1ccccc1Cl Show InChI InChI=1S/C38H32Cl2N4O5/c1-37(2,31(27-9-5-7-11-29(27)39)43-33(45)25-17-13-23(21-41)14-18-25)35(47)49-36(48)38(3,4)32(28-10-6-8-12-30(28)40)44-34(46)26-19-15-24(22-42)16-20-26/h5-20,31-32H,1-4H3,(H,43,45)(H,44,46)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070440 (CHEMBL35762 | {(S)-1-[(S)-1-(1-Benzylcarbamoyl-4-o...) Show SMILES CC(C)C[C@@H](CSC1CC(=O)N1C(=O)NCc1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C Show InChI InChI=1S/C28H44N4O5S/c1-18(2)14-20(30-24(34)23(27(3,4)5)31-26(36)37-28(6,7)8)17-38-22-15-21(33)32(22)25(35)29-16-19-12-10-9-11-13-19/h9-13,18,20,22-23H,14-17H2,1-8H3,(H,29,35)(H,30,34)(H,31,36)/t20-,22?,23+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075112 (1,1-dimethyl-2-propylcarboxamidooctanoic anhydride...) Show SMILES CCCCCC(NC(=O)CCC)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCCC)NC(=O)CCC Show InChI InChI=1S/C28H52N2O5/c1-9-13-15-19-21(29-23(31)17-11-3)27(5,6)25(33)35-26(34)28(7,8)22(20-16-14-10-2)30-24(32)18-12-4/h21-22H,9-20H2,1-8H3,(H,29,31)(H,30,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	810	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070444 ((3R,4S)-3-Methyl-2-oxo-4-(pyridin-2-ylmethylsulfan...) Show SMILES CC[C@@H](NC(=O)N1[C@@H](SCc2ccccn2)[C@H](C)C1=O)c1ccccc1 Show InChI InChI=1S/C20H23N3O2S/c1-3-17(15-9-5-4-6-10-15)22-20(25)23-18(24)14(2)19(23)26-13-16-11-7-8-12-21-16/h4-12,14,17,19H,3,13H2,1-2H3,(H,22,25)/t14-,17-,19+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50063719 (2-Isopropylamino-5-methyl-benzo[d][1,3]oxazin-4-on...) Show SMILES CC(C)Nc1nc2cccc(C)c2c(=O)o1 Show InChI InChI=1S/C12H14N2O2/c1-7(2)13-12-14-9-6-4-5-8(3)10(9)11(15)16-12/h4-7H,1-3H3,(H,13,14)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against human chymotrypsin				Bioorg Med Chem Lett 7: 2105-2108 (1997) Article DOI: 10.1016/S0960-894X(97)00368-5 BindingDB Entry DOI: 10.7270/Q2RR1Z6P
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50289948 (2-Dimethylamino-N-[5-methyl-4-oxo-2-(1-phenyl-ethy...) Show SMILES C[C@@H](Nc1nc2ccc(NC(=O)CN(C)C)c(C)c2c(=O)o1)c1ccccc1 Show InChI InChI=1S/C21H24N4O3/c1-13-16(23-18(26)12-25(3)4)10-11-17-19(13)20(27)28-21(24-17)22-14(2)15-8-6-5-7-9-15/h5-11,14H,12H2,1-4H3,(H,22,24)(H,23,26)/t14-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against human chymotrypsin				Bioorg Med Chem Lett 7: 2105-2108 (1997) Article DOI: 10.1016/S0960-894X(97)00368-5 BindingDB Entry DOI: 10.7270/Q2RR1Z6P
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50289950 (4-Methoxy-N-[5-methyl-4-oxo-2-(1-phenyl-ethylamino...) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1ccc2nc(N[C@H](C)c3ccccc3)oc(=O)c2c1C Show InChI InChI=1S/C24H23N3O5S/c1-15-20(27-33(29,30)19-11-9-18(31-3)10-12-19)13-14-21-22(15)23(28)32-24(26-21)25-16(2)17-7-5-4-6-8-17/h4-14,16,27H,1-3H3,(H,25,26)/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against human chymotrypsin				Bioorg Med Chem Lett 7: 2105-2108 (1997) Article DOI: 10.1016/S0960-894X(97)00368-5 BindingDB Entry DOI: 10.7270/Q2RR1Z6P
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50139465 (((S)-1-Mercaptomethyl-2-phenyl-ethyl)-carbamic aci...) Show SMILES SC[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C17H19NO2S/c19-17(20-12-15-9-5-2-6-10-15)18-16(13-21)11-14-7-3-1-4-8-14/h1-10,16,21H,11-13H2,(H,18,19)/t16-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pohang University of Science and Technology Curated by ChEMBL					Assay Description Inhibitory activity of the compound against chymotrypsinogen in the presence of Zn(II) (500 microM)				Bioorg Med Chem Lett 14: 701-5 (2004) BindingDB Entry DOI: 10.7270/Q2VM4BP6
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075117 (2-phenylcarboxamidopropanoic anhydride | CHEMBL134...) Show SMILES O=C(CCNC(=O)c1ccccc1)OC(=O)CCNC(=O)c1ccccc1 Show InChI InChI=1S/C20H20N2O5/c23-17(11-13-21-19(25)15-7-3-1-4-8-15)27-18(24)12-14-22-20(26)16-9-5-2-6-10-16/h1-10H,11-14H2,(H,21,25)(H,22,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against human leukocyte cathepsin G (h-CG)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50139460 (((R)-1-Mercaptomethyl-2-phenyl-ethyl)-carbamic aci...) Show SMILES SC[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C17H19NO2S/c19-17(20-12-15-9-5-2-6-10-15)18-16(13-21)11-14-7-3-1-4-8-14/h1-10,16,21H,11-13H2,(H,18,19)/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pohang University of Science and Technology Curated by ChEMBL					Assay Description Inhibitory activity of the compound against chymotrypsinogen in the presence of Zn(II) (500 microM)				Bioorg Med Chem Lett 14: 701-5 (2004) BindingDB Entry DOI: 10.7270/Q2VM4BP6
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50139463 ((S)-2-((S)-1-Mercaptomethyl-2-phenyl-ethylcarbamoy...) Show SMILES SC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 Show InChI InChI=1S/C22H26N2O3S/c25-21(23-19(16-28)14-17-8-3-1-4-9-17)20-12-7-13-24(20)22(26)27-15-18-10-5-2-6-11-18/h1-6,8-11,19-20,28H,7,12-16H2,(H,23,25)/t19-,20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pohang University of Science and Technology Curated by ChEMBL					Assay Description Inhibitory activity of the compound against chymotrypsinogen in the presence of Zn(II) (500 microM)				Bioorg Med Chem Lett 14: 701-5 (2004) BindingDB Entry DOI: 10.7270/Q2VM4BP6
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070442 (CHEMBL263736 | {(S)-1-[(S)-1-(1-Benzylcarbamoyl-4-...) Show SMILES CC(C)C[C@@H](COC1CC(=O)N1C(=O)NCc1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C Show InChI InChI=1S/C28H44N4O6/c1-18(2)14-20(30-24(34)23(27(3,4)5)31-26(36)38-28(6,7)8)17-37-22-15-21(33)32(22)25(35)29-16-19-12-10-9-11-13-19/h9-13,18,20,22-23H,14-17H2,1-8H3,(H,29,35)(H,30,34)(H,31,36)/t20-,22?,23+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50075115 (4-phenyl-2-phenylcarboxamidopentanoic anhydride | ...) Show SMILES O=C(CC(CCc1ccccc1)NC(=O)c1ccccc1)OC(=O)CC(CCc1ccccc1)NC(=O)c1ccccc1 Show InChI InChI=1S/C36H36N2O5/c39-33(25-31(23-21-27-13-5-1-6-14-27)37-35(41)29-17-9-3-10-18-29)43-34(40)26-32(24-22-28-15-7-2-8-16-28)38-36(42)30-19-11-4-12-20-30/h1-20,31-32H,21-26H2,(H,37,41)(H,38,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Steel Corporation Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic alpha-chymotrypsin (alpha-CT)				Bioorg Med Chem Lett 9: 413-8 (1999) BindingDB Entry DOI: 10.7270/Q2BK1BGC
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50142276 (2-Ethyl-1,1-dioxo-1,2,3,4,6,7-hexahydro-5,8-dioxa-...) Show SMILES CCN1C(Cc2cc3OCCOc3cc2S1(=O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NCCNS(=O)(=O)c1ccccc1 Show InChI InChI=1S/C31H34N4O9S2/c1-2-35-25(18-22-19-26-27(44-16-15-43-26)20-28(22)46(35,41)42)30(37)34-24(17-21-9-5-3-6-10-21)29(36)31(38)32-13-14-33-45(39,40)23-11-7-4-8-12-23/h3-12,19-20,24-25,33H,2,13-18H2,1H3,(H,32,38)(H,34,37)/t24-,25?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Cephalon, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human calpain 1 in Molt-4 cells (intact human T-cell leukemia cell line)				Bioorg Med Chem Lett 14: 1035-8 (2004) Article DOI: 10.1016/j.bmcl.2003.11.037 BindingDB Entry DOI: 10.7270/Q27H1K45
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50142275 (2-Ethyl-1,1-dioxo-1,2,3,4,6,7-hexahydro-5,8-dioxa-...) Show SMILES CCN1C(Cc2cc3OCCOc3cc2S1(=O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NCCNS(=O)(=O)c1ccc(s1)-c1ccccn1 Show InChI InChI=1S/C34H35N5O9S3/c1-2-39-26(19-23-20-27-28(48-17-16-47-27)21-30(23)51(39,45)46)33(41)38-25(18-22-8-4-3-5-9-22)32(40)34(42)36-14-15-37-50(43,44)31-12-11-29(49-31)24-10-6-7-13-35-24/h3-13,20-21,25-26,37H,2,14-19H2,1H3,(H,36,42)(H,38,41)/t25-,26?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Cephalon, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against chymotrypsinogen; Range 1-10 uM				Bioorg Med Chem Lett 14: 1035-8 (2004) Article DOI: 10.1016/j.bmcl.2003.11.037 BindingDB Entry DOI: 10.7270/Q27H1K45
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50139462 (CHEMBL352899 | N-((S)-1-Mercaptomethyl-2-phenyl-et...) Show SMILES SC[C@H](Cc1ccccc1)NC(=O)c1ccccc1 Show InChI InChI=1S/C16H17NOS/c18-16(14-9-5-2-6-10-14)17-15(12-19)11-13-7-3-1-4-8-13/h1-10,15,19H,11-12H2,(H,17,18)/t15-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pohang University of Science and Technology Curated by ChEMBL					Assay Description Inhibitory activity of the compound against chymotrypsinogen in the presence of Zn(II) (500 microM)				Bioorg Med Chem Lett 14: 701-5 (2004) BindingDB Entry DOI: 10.7270/Q2VM4BP6
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50289951 (CHEMBL63952 | [5-Methyl-4-oxo-2-(1-phenyl-ethylami...) Show SMILES C[C@@H](Nc1nc2ccc(NC(=O)OC(C)(C)C)c(C)c2c(=O)o1)c1ccccc1 Show InChI InChI=1S/C22H25N3O4/c1-13-16(25-21(27)29-22(3,4)5)11-12-17-18(13)19(26)28-20(24-17)23-14(2)15-9-7-6-8-10-15/h6-12,14H,1-5H3,(H,23,24)(H,25,27)/t14-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against human chymotrypsin				Bioorg Med Chem Lett 7: 2105-2108 (1997) Article DOI: 10.1016/S0960-894X(97)00368-5 BindingDB Entry DOI: 10.7270/Q2RR1Z6P
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070443 (((S)-2,2-Dimethyl-1-{(S)-3-methyl-1-[4-oxo-1-((R)-...) Show SMILES CC(C)C[C@@H](COC1CC(=O)N1C(=O)N[C@H](C)c1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C Show InChI InChI=1S/C29H46N4O6/c1-18(2)15-21(31-25(35)24(28(4,5)6)32-27(37)39-29(7,8)9)17-38-23-16-22(34)33(23)26(36)30-19(3)20-13-11-10-12-14-20/h10-14,18-19,21,23-24H,15-17H2,1-9H3,(H,30,36)(H,31,35)(H,32,37)/t19-,21+,23?,24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070449 (2-Oxo-4-(pyridin-2-ylmethylsulfanyl)-azetidine-1-c...) Show SMILES OC[C@@H](NC(=O)N1C(CC1=O)SCc1ccccn1)c1ccccc1 Show InChI InChI=1S/C18H19N3O3S/c22-11-15(13-6-2-1-3-7-13)20-18(24)21-16(23)10-17(21)25-12-14-8-4-5-9-19-14/h1-9,15,17,22H,10-12H2,(H,20,24)/t15-,17?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070447 (2-Oxo-4-(pyridin-4-ylmethylsulfanyl)-azetidine-1-c...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)SCc1ccncc1)c1ccccc1 Show InChI InChI=1S/C18H19N3O2S/c1-13(15-5-3-2-4-6-15)20-18(23)21-16(22)11-17(21)24-12-14-7-9-19-10-8-14/h2-10,13,17H,11-12H2,1H3,(H,20,23)/t13-,17?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070438 (2-Oxo-4-(2-oxo-2-phenyl-ethylsulfanyl)-azetidine-1...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)SCC(=O)c1ccccc1)c1ccccc1 Show InChI InChI=1S/C20H20N2O3S/c1-14(15-8-4-2-5-9-15)21-20(25)22-18(24)12-19(22)26-13-17(23)16-10-6-3-7-11-16/h2-11,14,19H,12-13H2,1H3,(H,21,25)/t14-,19?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070437 (2-Oxo-4-phenethylsulfanyl-azetidine-1-carboxylic a...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)SCCc1ccccc1)c1ccccc1 Show InChI InChI=1S/C20H22N2O2S/c1-15(17-10-6-3-7-11-17)21-20(24)22-18(23)14-19(22)25-13-12-16-8-4-2-5-9-16/h2-11,15,19H,12-14H2,1H3,(H,21,24)/t15-,19?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50065878 (2-Oxo-4-phenylsulfanyl-azetidine-1-carboxylic acid...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)Sc1ccccc1)c1ccccc1 Show InChI InChI=1S/C18H18N2O2S/c1-13(14-8-4-2-5-9-14)19-18(22)20-16(21)12-17(20)23-15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3,(H,19,22)/t13-,17?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070446 (((S)-2,2-Dimethyl-1-{(S)-3-methyl-1-[4-oxo-1-((S)-...) Show SMILES CC(C)C[C@@H](COC1CC(=O)N1C(=O)N[C@@H](C)c1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C Show InChI InChI=1S/C29H46N4O6/c1-18(2)15-21(31-25(35)24(28(4,5)6)32-27(37)39-29(7,8)9)17-38-23-16-22(34)33(23)26(36)30-19(3)20-13-11-10-12-14-20/h10-14,18-19,21,23-24H,15-17H2,1-9H3,(H,30,36)(H,31,35)(H,32,37)/t19-,21-,23?,24+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070434 (CHEMBL288793 | {4-[4-Oxo-1-((R)-1-phenyl-ethylcarb...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)SCc1ccc(CC(=O)OC(C)(C)C)cc1)c1ccccc1 Show InChI InChI=1S/C25H30N2O4S/c1-17(20-8-6-5-7-9-20)26-24(30)27-21(28)15-22(27)32-16-19-12-10-18(11-13-19)14-23(29)31-25(2,3)4/h5-13,17,22H,14-16H2,1-4H3,(H,26,30)/t17-,22?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070435 (2-Oxo-4-(pyridin-2-ylmethylsulfanyl)-azetidine-1-c...) Show SMILES CC[C@@H](NC(=O)N1C(CC1=O)SCc1ccccn1)c1ccccc1 Show InChI InChI=1S/C19H21N3O2S/c1-2-16(14-8-4-3-5-9-14)21-19(24)22-17(23)12-18(22)25-13-15-10-6-7-11-20-15/h3-11,16,18H,2,12-13H2,1H3,(H,21,24)/t16-,18?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070436 (2-Oxo-4-(pyridin-2-ylmethylsulfanyl)-azetidine-1-c...) Show SMILES O=C(NCCOCc1ccccc1)N1C(CC1=O)SCc1ccccn1 Show InChI InChI=1S/C19H21N3O3S/c23-17-12-18(26-14-16-8-4-5-9-20-16)22(17)19(24)21-10-11-25-13-15-6-2-1-3-7-15/h1-9,18H,10-14H2,(H,21,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070439 (2-{(S)-2-[(S)-2-(3,3-Dimethyl-butyrylamino)-3,3-di...) Show SMILES CC[C@H](NC(=O)N1C(CC1=O)SC[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)(C)C)C(C)(C)C)c1ccccc1 Show InChI InChI=1S/C31H50N4O4S/c1-10-23(21-14-12-11-13-15-21)33-29(39)35-25(37)17-26(35)40-19-22(16-20(2)3)32-28(38)27(31(7,8)9)34-24(36)18-30(4,5)6/h11-15,20,22-23,26-27H,10,16-19H2,1-9H3,(H,32,38)(H,33,39)(H,34,36)/t22-,23-,26?,27+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070445 (2-Oxo-4-(pyridin-2-ylmethylsulfanyl)-azetidine-1-c...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)SCc1ccccn1)c1ccccc1 Show InChI InChI=1S/C18H19N3O2S/c1-13(14-7-3-2-4-8-14)20-18(23)21-16(22)11-17(21)24-12-15-9-5-6-10-19-15/h2-10,13,17H,11-12H2,1H3,(H,20,23)/t13-,17?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070448 (2-Benzylsulfanyl-4-oxo-azetidine-1-carboxylic acid...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)SCc1ccccc1)c1ccccc1 Show InChI InChI=1S/C19H20N2O2S/c1-14(16-10-6-3-7-11-16)20-19(23)21-17(22)12-18(21)24-13-15-8-4-2-5-9-15/h2-11,14,18H,12-13H2,1H3,(H,20,23)/t14-,18?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair
Chymotrypsinogen B (Homo sapiens (Human))	BDBM50070441 (2-Oxo-4-(pyridin-3-ylmethylsulfanyl)-azetidine-1-c...) Show SMILES C[C@@H](NC(=O)N1C(CC1=O)SCc1cccnc1)c1ccccc1 Show InChI InChI=1S/C18H19N3O2S/c1-13(15-7-3-2-4-8-15)20-18(23)21-16(22)10-17(21)24-12-14-6-5-9-19-11-14/h2-9,11,13,17H,10,12H2,1H3,(H,20,23)/t13-,17?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim (Canada) Ltd Curated by ChEMBL					Assay Description Inhibitory activity against alpha-chymotrypsin				Bioorg Med Chem Lett 8: 1437-42 (1999) BindingDB Entry DOI: 10.7270/Q2J67G20
					More data for this Ligand-Target Pair

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