Compile Data Set for Download or QSAR

Found 276 hits of ic50 for UniProtKB: P80209   

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
Cathepsin D (Bos taurus)	BDBM50022521 (Boc-Phe-His-Cha-CH2-S-Leu-NHCO(CH2)2C6H5 | CHEMBL3...) Show SMILES CC(C)CC(NC(=O)CCc1ccccc1)SCC(O)C(CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C44H64N6O6S/c1-30(2)23-40(50-39(52)22-21-31-15-9-6-10-16-31)57-28-38(51)35(24-32-17-11-7-12-18-32)47-42(54)37(26-34-27-45-29-46-34)48-41(53)36(25-33-19-13-8-14-20-33)49-43(55)56-44(3,4)5/h6,8-10,13-16,19-20,27,29-30,32,35-38,40,51H,7,11-12,17-18,21-26,28H2,1-5H3,(H,45,46)(H,47,54)(H,48,53)(H,49,55)(H,50,52)/t35?,36-,37-,38?,40?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1	n/a	n/a	n/a	n/a	3.2	n/a
University of Wisconsin Curated by ChEMBL					Assay Description Inhibition of bovine cathepsin D at pH 3.1				J Med Chem 31: 625-9 (1988) BindingDB Entry DOI: 10.7270/Q2B85742
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50022518 (CHEMBL407670 | Pro-His-Pro-Phe-His-Leu-CH2NH-Val-I...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(O)=O Show InChI InChI=1S/C60H91N17O10/c1-7-37(6)51(58(84)74-47(26-40-29-63-33-68-40)55(81)71-44(60(86)87)17-11-12-20-61)76-57(83)50(36(4)5)66-31-42(23-35(2)3)70-53(79)46(25-39-28-62-32-67-39)72-54(80)45(24-38-15-9-8-10-16-38)73-56(82)49-19-14-22-77(49)59(85)48(27-41-30-64-34-69-41)75-52(78)43-18-13-21-65-43/h8-10,15-16,28-30,32-37,42-51,65-66H,7,11-14,17-27,31,61H2,1-6H3,(H,62,67)(H,63,68)(H,64,69)(H,70,79)(H,71,81)(H,72,80)(H,73,82)(H,74,84)(H,75,78)(H,76,83)(H,86,87)/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	3.3	n/a
University of Wisconsin Curated by ChEMBL					Assay Description Inhibition of bovine cathepsin D at pH 3.3(no inhibition)				J Med Chem 31: 625-9 (1988) BindingDB Entry DOI: 10.7270/Q2B85742
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50022510 (Boc-Phe-His-Leu-CF3-Ile-Amp | CHEMBL154795) Show SMILES CC[C@H](C)[C@H](NC(=O)C(F)(F)C(=O)C(CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccn1 Show InChI InChI=1S/C40H54F2N8O7/c1-8-25(4)32(36(54)45-22-27-16-12-13-17-44-27)50-37(55)40(41,42)33(51)29(18-24(2)3)47-35(53)31(20-28-21-43-23-46-28)48-34(52)30(19-26-14-10-9-11-15-26)49-38(56)57-39(5,6)7/h9-17,21,23-25,29-32H,8,18-20,22H2,1-7H3,(H,43,46)(H,45,54)(H,47,53)(H,48,52)(H,49,56)(H,50,55)/t25-,29?,30-,31-,32-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	3.2	n/a
University of Wisconsin Curated by ChEMBL					Assay Description Inhibition of human pepsin at pH 3.1				J Med Chem 31: 625-9 (1988) BindingDB Entry DOI: 10.7270/Q2B85742
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50022510 (Boc-Phe-His-Leu-CF3-Ile-Amp | CHEMBL154795) Show SMILES CC[C@H](C)[C@H](NC(=O)C(F)(F)C(=O)C(CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccn1 Show InChI InChI=1S/C40H54F2N8O7/c1-8-25(4)32(36(54)45-22-27-16-12-13-17-44-27)50-37(55)40(41,42)33(51)29(18-24(2)3)47-35(53)31(20-28-21-43-23-46-28)48-34(52)30(19-26-14-10-9-11-15-26)49-38(56)57-39(5,6)7/h9-17,21,23-25,29-32H,8,18-20,22H2,1-7H3,(H,43,46)(H,45,54)(H,47,53)(H,48,52)(H,49,56)(H,50,55)/t25-,29?,30-,31-,32-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	3.2	n/a
University of Wisconsin Curated by ChEMBL					Assay Description Inhibition of bovine cathepsin D at pH 3.1				J Med Chem 31: 625-9 (1988) BindingDB Entry DOI: 10.7270/Q2B85742
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50022508 (Boc-Pro-Phe-NMe-His-Leu-OHCH2-Val-Ile-Amp | CHEMBL...) Show SMILES CC[C@H](C)[C@H](NC(=O)C(CC(O)C(CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(C)C)C(=O)NCc1ccccn1 Show InChI InChI=1S/C50H75N9O8/c1-11-33(6)43(47(64)53-29-35-20-15-16-22-52-35)57-44(61)37(32(4)5)27-42(60)38(24-31(2)3)55-46(63)41(26-36-28-51-30-54-36)58(10)48(65)39(25-34-18-13-12-14-19-34)56-45(62)40-21-17-23-59(40)49(66)67-50(7,8)9/h12-16,18-20,22,28,30-33,37-43,60H,11,17,21,23-27,29H2,1-10H3,(H,51,54)(H,53,64)(H,55,63)(H,56,62)(H,57,61)/t33-,37?,38?,39-,40-,41-,42?,43-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.30	n/a	n/a	n/a	n/a	3.2	n/a
University of Wisconsin Curated by ChEMBL					Assay Description Inhibition of bovine cathepsin D at pH 3.2				J Med Chem 31: 625-9 (1988) BindingDB Entry DOI: 10.7270/Q2B85742
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005417 (CHEMBL266334 | N-[(1-Cyclohexylmethyl-2,3-dihydrox...) Show SMILES CCSC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C31H52N4O7S2/c1-4-43-31(30(39)32-25(20-23-11-7-5-8-12-23)28(37)27(36)19-22(2)3)33-29(38)26(21-24-13-9-6-10-14-24)34-44(40,41)35-15-17-42-18-16-35/h6,9-10,13-14,22-23,25-28,31,34,36-37H,4-5,7-8,11-12,15-21H2,1-3H3,(H,32,39)(H,33,38)/t25-,26-,27-,28+,31?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM912 ((3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-m...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O |r| Show InChI InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Kissei Pharmaceutical Company, Ltd. Curated by ChEMBL					Assay Description Tested for inhibition of Cathepsin D from bovine				J Med Chem 33: 2707-14 (1990) BindingDB Entry DOI: 10.7270/Q2N29XJZ
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005436 (4-{2-Allylsulfanyl-2-[2-(morpholine-4-sulfonylamin...) Show SMILES O[C@@H](CC(=O)NCCN1CCOCC1)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)SCC=C Show InChI InChI=1S/C35H56N6O8S2/c1-2-23-50-35(38-33(44)30(25-28-11-7-4-8-12-28)39-51(46,47)41-17-21-49-22-18-41)34(45)37-29(24-27-9-5-3-6-10-27)31(42)26-32(43)36-13-14-40-15-19-48-20-16-40/h2,4,7-8,11-12,27,29-31,35,39,42H,1,3,5-6,9-10,13-26H2,(H,36,43)(H,37,45)(H,38,44)/t29-,30-,31-,35?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50008152 (4-(1-{1-[1-Cyclohexylmethyl-3,3-difluoro-3-(2-meth...) Show SMILES CC[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C Show InChI InChI=1S/C39H60F2N6O8S/c1-7-15-30(34(49)44-31(24-28-16-11-9-12-17-28)33(48)39(40,41)36(51)42-26-27(3)8-2)43-35(50)32(25-29-18-13-10-14-19-29)45-56(53,54)47-22-20-46(21-23-47)37(52)55-38(4,5)6/h7,10,13-14,18-19,27-28,30-32,45H,1,8-9,11-12,15-17,20-26H2,2-6H3,(H,42,51)(H,43,50)(H,44,49)/t27-,30-,31-,32-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine Cathepsin D				J Med Chem 35: 2-14 (1992) BindingDB Entry DOI: 10.7270/Q22J6CGV
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005442 (CHEMBL262712 | N-[Allyloxy-(1-cyclohexylmethyl-2,3...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)OCC=C Show InChI InChI=1S/C32H52N4O8S/c1-4-17-44-32(31(40)33-26(21-24-11-7-5-8-12-24)29(38)28(37)20-23(2)3)34-30(39)27(22-25-13-9-6-10-14-25)35-45(41,42)36-15-18-43-19-16-36/h4,6,9-10,13-14,23-24,26-29,32,35,37-38H,1,5,7-8,11-12,15-22H2,2-3H3,(H,33,40)(H,34,39)/t26-,27-,28-,29+,32?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005428 (CHEMBL8836 | N-[(1-Cyclohexylmethyl-2,3-dihydroxy-...) Show SMILES CCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C31H52N4O8S/c1-4-43-31(30(39)32-25(20-23-11-7-5-8-12-23)28(37)27(36)19-22(2)3)33-29(38)26(21-24-13-9-6-10-14-24)34-44(40,41)35-15-17-42-18-16-35/h6,9-10,13-14,22-23,25-28,31,34,36-37H,4-5,7-8,11-12,15-21H2,1-3H3,(H,32,39)(H,33,38)/t25-,26-,27-,28+,31?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50407076 (CHEMBL2112270) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCC(C)C Show InChI InChI=1S/C32H60N4O6/c1-10-22(6)28(30(40)34-24(16-20(2)3)26(37)18-27(38)33-19-21(4)5)36-29(39)25(17-23-14-12-11-13-15-23)35-31(41)42-32(7,8)9/h20-26,28,37H,10-19H2,1-9H3,(H,33,38)(H,34,40)(H,35,41)(H,36,39)/t22-,24-,25-,26-,28-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50008149 (2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propion...) Show SMILES CCS[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C34H51F2N5O7S2/c1-4-12-27(38-32(44)29(22-26-15-10-7-11-16-26)40-50(46,47)41-17-19-48-20-18-41)31(43)39-28(21-25-13-8-6-9-14-25)30(42)34(35,36)33(45)37-23-24(3)49-5-2/h4,7,10-11,15-16,24-25,27-29,40H,1,5-6,8-9,12-14,17-23H2,2-3H3,(H,37,45)(H,38,44)(H,39,43)/t24-,27+,28+,29+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine Cathepsin D				J Med Chem 35: 2-14 (1992) BindingDB Entry DOI: 10.7270/Q22J6CGV
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005437 (CHEMBL8477 | N-[Allylsulfanyl-(1-cyclohexylmethyl-...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)SCC=C Show InChI InChI=1S/C32H52N4O7S2/c1-4-19-44-32(31(40)33-26(21-24-11-7-5-8-12-24)29(38)28(37)20-23(2)3)34-30(39)27(22-25-13-9-6-10-14-25)35-45(41,42)36-15-17-43-18-16-36/h4,6,9-10,13-14,23-24,26-29,32,35,37-38H,1,5,7-8,11-12,15-22H2,2-3H3,(H,33,40)(H,34,39)/t26-,27-,28-,29+,32?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50407086 (CHEMBL2112265) Show SMILES CCOC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)CC)[C@@H](C)CC Show InChI InChI=1S/C27H51N3O7/c1-11-17(6)22(24(33)28-19(14-16(4)5)20(31)15-21(32)36-13-3)29-25(34)23(18(7)12-2)30-26(35)37-27(8,9)10/h16-20,22-23,31H,11-15H2,1-10H3,(H,28,33)(H,29,34)(H,30,35)/t17-,18+,19-,20-,22-,23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005443 (CHEMBL441325 | N-[(1-Cyclohexylmethyl-2,3-dihydrox...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)OCC(F)(F)F Show InChI InChI=1S/C31H49F3N4O8S/c1-21(2)17-26(39)27(40)24(18-22-9-5-3-6-10-22)35-29(42)30(46-20-31(32,33)34)36-28(41)25(19-23-11-7-4-8-12-23)37-47(43,44)38-13-15-45-16-14-38/h4,7-8,11-12,21-22,24-27,30,37,39-40H,3,5-6,9-10,13-20H2,1-2H3,(H,35,42)(H,36,41)/t24-,25-,26-,27+,30?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005431 (CHEMBL8665 | N-[(1-Cyclohexylmethyl-2,3-dihydroxy-...) Show SMILES CCCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C32H54N4O8S/c1-4-17-44-32(31(40)33-26(21-24-11-7-5-8-12-24)29(38)28(37)20-23(2)3)34-30(39)27(22-25-13-9-6-10-14-25)35-45(41,42)36-15-18-43-19-16-36/h6,9-10,13-14,23-24,26-29,32,35,37-38H,4-5,7-8,11-12,15-22H2,1-3H3,(H,33,40)(H,34,39)/t26-,27-,28-,29+,32?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50282993 ((2S,4R)-4-Cyclohexyl-2-hydroxy-3-((R)-3-methylsulf...) Show SMILES CSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(=O)OC(C)C Show InChI InChI=1S/C31H48N4O7S/c1-21(2)42-30(39)27(36)24(18-22-10-6-4-7-11-22)32-29(38)26(20-43-3)33-28(37)25(19-23-12-8-5-9-13-23)34-31(40)35-14-16-41-17-15-35/h5,8-9,12-13,21-22,24-27,36H,4,6-7,10-11,14-20H2,1-3H3,(H,32,38)(H,33,37)(H,34,40)/t24-,25-,26-,27+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory concentration on Bovine Cathepsin D				J Med Chem 34: 1935-43 (1991) BindingDB Entry DOI: 10.7270/Q2NG4R73
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50008129 (2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propion...) Show SMILES FC(F)(C(=O)NCCc1ccccn1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C36H48F2N6O7S/c1-2-11-29(41-34(47)31(25-27-14-7-4-8-15-27)43-52(49,50)44-20-22-51-23-21-44)33(46)42-30(24-26-12-5-3-6-13-26)32(45)36(37,38)35(48)40-19-17-28-16-9-10-18-39-28/h2,4,7-10,14-16,18,26,29-31,43H,1,3,5-6,11-13,17,19-25H2,(H,40,48)(H,41,47)(H,42,46)/t29-,30-,31-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine Cathepsin D				J Med Chem 35: 2-14 (1992) BindingDB Entry DOI: 10.7270/Q22J6CGV
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50012250 (CHEMBL58947 | N-(1-Cyclohexylmethyl-2,3-dihydroxy-...) Show SMILES COC(=O)CC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C Show InChI InChI=1S/C32H52N4O9S/c1-22(2)18-28(37)30(39)25(19-23-10-6-4-7-11-23)33-31(40)26(21-29(38)44-3)34-32(41)27(20-24-12-8-5-9-13-24)35-46(42,43)36-14-16-45-17-15-36/h5,8-9,12-13,22-23,25-28,30,35,37,39H,4,6-7,10-11,14-21H2,1-3H3,(H,33,40)(H,34,41)/t25-,26?,27-,28+,30+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibition of Bovine Cathepsin D.				J Med Chem 34: 1935-43 (1991) BindingDB Entry DOI: 10.7270/Q2NG4R73
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM912 ((3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-m...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O |r| Show InChI InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of bovine cathepsin D				J Med Chem 29: 2088-93 (1986) BindingDB Entry DOI: 10.7270/Q2251JRT
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM912 ((3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-m...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O |r| Show InChI InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was evaluated against bovine cathepsin D (sigma)				J Med Chem 28: 1553-5 (1985) BindingDB Entry DOI: 10.7270/Q23B60QP
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50010424 (BOC-Phe-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrim...) Show SMILES CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N Show InChI InChI=1S/C40H62N8O7/c1-8-24(2)34(38(53)43-23-29-22-42-26(4)45-35(29)41)48-33(50)21-32(49)30(19-27-15-11-9-12-16-27)46-36(51)25(3)44-37(52)31(20-28-17-13-10-14-18-28)47-39(54)55-40(5,6)7/h10,13-14,17-18,22,24-25,27,30-32,34,49H,8-9,11-12,15-16,19-21,23H2,1-7H3,(H,43,53)(H,44,52)(H,46,51)(H,47,54)(H,48,50)(H2,41,42,45)/t24-,25-,30-,31-,32-,34-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
E. Merck Darmstadt Curated by ChEMBL					Assay Description In vitro inhibitory activity against bovine Cathepsin D				J Med Chem 34: 3267-80 (1991) BindingDB Entry DOI: 10.7270/Q2G161FT
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005439 ((1-{[(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-he...) Show SMILES CCSC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C32H53N3O6S/c1-7-42-30(29(39)33-24(19-22-14-10-8-11-15-22)27(37)26(36)18-21(2)3)35-28(38)25(20-23-16-12-9-13-17-23)34-31(40)41-32(4,5)6/h9,12-13,16-17,21-22,24-27,30,36-37H,7-8,10-11,14-15,18-20H2,1-6H3,(H,33,39)(H,34,40)(H,35,38)/t24-,25-,26-,27+,30?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM912 ((3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-m...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O |r| Show InChI InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of bovine cathepsin D				J Med Chem 29: 2080-7 (1986) BindingDB Entry DOI: 10.7270/Q25X29G7
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50012247 (4-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl...) Show SMILES COC(=O)CCC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C Show InChI InChI=1S/C33H54N4O9S/c1-23(2)20-29(38)31(40)27(21-24-10-6-4-7-11-24)35-32(41)26(14-15-30(39)45-3)34-33(42)28(22-25-12-8-5-9-13-25)36-47(43,44)37-16-18-46-19-17-37/h5,8-9,12-13,23-24,26-29,31,36,38,40H,4,6-7,10-11,14-22H2,1-3H3,(H,34,42)(H,35,41)/t26?,27-,28-,29+,31+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibition of Bovine Cathepsin D.				J Med Chem 34: 1935-43 (1991) BindingDB Entry DOI: 10.7270/Q2NG4R73
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50006860 (CHEMBL85672 | {1-[2-(2-Amino-thiazol-4-yl)-1-(1-cy...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NP(=O)(OC(C)C)OC(C)C Show InChI InChI=1S/C35H58N5O7PS/c1-22(2)17-31(41)32(42)28(18-25-13-9-7-10-14-25)38-33(43)29(20-27-21-49-35(36)37-27)39-34(44)30(19-26-15-11-8-12-16-26)40-48(45,46-23(3)4)47-24(5)6/h8,11-12,15-16,21-25,28-32,41-42H,7,9-10,13-14,17-20H2,1-6H3,(H2,36,37)(H,38,43)(H,39,44)(H,40,45)/t28-,29-,30-,31-,32+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. Curated by ChEMBL					Assay Description Compound was evaluated for the percent inhibition of Cathepsin D in Bovine				J Med Chem 35: 2562-72 (1992) BindingDB Entry DOI: 10.7270/Q2ZK5H8V
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50008145 (CHEMBL286147 | Morpholine-4-carboxylic acid (1-{1-...) Show SMILES FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 Show InChI InChI=1S/C36H52F2N6O7/c1-2-9-28(40-33(47)30(25-27-12-7-4-8-13-27)42-35(49)44-18-22-51-23-19-44)32(46)41-29(24-26-10-5-3-6-11-26)31(45)36(37,38)34(48)39-14-15-43-16-20-50-21-17-43/h2,4,7-8,12-13,26,28-30H,1,3,5-6,9-11,14-25H2,(H,39,48)(H,40,47)(H,41,46)(H,42,49)/t28-,29-,30-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine Cathepsin D				J Med Chem 35: 2-14 (1992) BindingDB Entry DOI: 10.7270/Q22J6CGV
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50006853 (CHEMBL315211 | N-(1-Cyclohexylmethyl-2,3-dihydroxy...) Show SMILES COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C31H50N4O9S/c1-21(2)18-26(36)28(37)24(19-22-10-6-4-7-11-22)32-30(39)27(31(40)43-3)33-29(38)25(20-23-12-8-5-9-13-23)34-45(41,42)35-14-16-44-17-15-35/h5,8-9,12-13,21-22,24-28,34,36-37H,4,6-7,10-11,14-20H2,1-3H3,(H,32,39)(H,33,38)/t24-,25-,26-,27+,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. Curated by ChEMBL					Assay Description Compound was evaluated for the percent inhibition of Cathepsin D in Bovine				J Med Chem 35: 2562-72 (1992) BindingDB Entry DOI: 10.7270/Q2ZK5H8V
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50012246 (CHEMBL58153 | N-(1-Cyclohexylmethyl-2,3-dihydroxy-...) Show SMILES COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C Show InChI InChI=1S/C31H50N4O9S/c1-21(2)18-26(36)28(37)24(19-22-10-6-4-7-11-22)32-30(39)27(31(40)43-3)33-29(38)25(20-23-12-8-5-9-13-23)34-45(41,42)35-14-16-44-17-15-35/h5,8-9,12-13,21-22,24-28,34,36-37H,4,6-7,10-11,14-20H2,1-3H3,(H,32,39)(H,33,38)/t24-,25-,26+,27?,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibition of monkey plasma renin				J Med Chem 34: 1935-43 (1991) BindingDB Entry DOI: 10.7270/Q2NG4R73
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50008133 (2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propion...) Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 Show InChI InChI=1S/C36H56F2N6O8S/c1-2-3-14-29(40-34(47)31(26-28-12-8-5-9-13-28)42-53(49,50)44-19-23-52-24-20-44)33(46)41-30(25-27-10-6-4-7-11-27)32(45)36(37,38)35(48)39-15-16-43-17-21-51-22-18-43/h5,8-9,12-13,27,29-31,42H,2-4,6-7,10-11,14-26H2,1H3,(H,39,48)(H,40,47)(H,41,46)/t29-,30-,31-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine Cathepsin D				J Med Chem 35: 2-14 (1992) BindingDB Entry DOI: 10.7270/Q22J6CGV
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50012246 (CHEMBL58153 | N-(1-Cyclohexylmethyl-2,3-dihydroxy-...) Show SMILES COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C Show InChI InChI=1S/C31H50N4O9S/c1-21(2)18-26(36)28(37)24(19-22-10-6-4-7-11-22)32-30(39)27(31(40)43-3)33-29(38)25(20-23-12-8-5-9-13-23)34-45(41,42)35-14-16-44-17-15-35/h5,8-9,12-13,21-22,24-28,34,36-37H,4,6-7,10-11,14-20H2,1-3H3,(H,32,39)(H,33,38)/t24-,25-,26+,27?,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor mu 1 using [3H]-etorphine as a radioligand				J Med Chem 34: 1935-43 (1991) BindingDB Entry DOI: 10.7270/Q2NG4R73
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50407087 (CHEMBL2112258) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCc1ccccn1 Show InChI InChI=1S/C35H59N5O6/c1-8-24(4)31(40-32(43)28(21-25-14-10-9-11-15-25)39-34(45)46-35(5,6)7)33(44)38-27(20-23(2)3)29(41)22-30(42)37-19-17-26-16-12-13-18-36-26/h12-13,16,18,23-25,27-29,31,41H,8-11,14-15,17,19-22H2,1-7H3,(H,37,42)(H,38,44)(H,39,45)(H,40,43)/t24-,27-,28-,29-,31-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50008158 (2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propion...) Show SMILES CCS[C@H](C)CNC(=O)C(F)(F)C(O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C34H53F2N5O7S2/c1-4-12-27(38-32(44)29(22-26-15-10-7-11-16-26)40-50(46,47)41-17-19-48-20-18-41)31(43)39-28(21-25-13-8-6-9-14-25)30(42)34(35,36)33(45)37-23-24(3)49-5-2/h4,7,10-11,15-16,24-25,27-30,40,42H,1,5-6,8-9,12-14,17-23H2,2-3H3,(H,37,45)(H,38,44)(H,39,43)/t24-,27+,28+,29+,30?/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine Cathepsin D				J Med Chem 35: 2-14 (1992) BindingDB Entry DOI: 10.7270/Q22J6CGV
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50012249 (CHEMBL58256 | N-(1-Cyclohexylmethyl-2,3-dihydroxy-...) Show SMILES CC(C)C[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)OC(C)C Show InChI InChI=1S/C33H54N4O9S/c1-22(2)19-28(38)30(39)26(20-24-11-7-5-8-12-24)34-32(41)29(33(42)46-23(3)4)35-31(40)27(21-25-13-9-6-10-14-25)36-47(43,44)37-15-17-45-18-16-37/h6,9-10,13-14,22-24,26-30,36,38-39H,5,7-8,11-12,15-21H2,1-4H3,(H,34,41)(H,35,40)/t26-,27-,28+,29?,30+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibition of Bovine Cathepsin D.				J Med Chem 34: 1935-43 (1991) BindingDB Entry DOI: 10.7270/Q2NG4R73
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50022866 (4-[1-{3-[1-[1-(1-amino-1-methylpropylcarboxamido)-...) Show SMILES CCC(C)(N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NC(CC(C)C)C(O)CC(=O)N[C@@H](C)C(=O)NC(CC(C)C)C(O)CC(O)=O Show InChI InChI=1S/C34H64N6O9/c1-12-34(11,35)33(49)40-29(20(8)9)32(48)39-28(19(6)7)31(47)38-22(13-17(2)3)24(41)15-26(43)36-21(10)30(46)37-23(14-18(4)5)25(42)16-27(44)45/h17-25,28-29,41-42H,12-16,35H2,1-11H3,(H,36,43)(H,37,46)(H,38,47)(H,39,48)(H,40,49)(H,44,45)/t21-,22?,23?,24?,25?,28-,29-,34?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 31: 284-95 (1988) BindingDB Entry DOI: 10.7270/Q2S75FBX
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50012246 (CHEMBL58153 | N-(1-Cyclohexylmethyl-2,3-dihydroxy-...) Show SMILES COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C Show InChI InChI=1S/C31H50N4O9S/c1-21(2)18-26(36)28(37)24(19-22-10-6-4-7-11-22)32-30(39)27(31(40)43-3)33-29(38)25(20-23-12-8-5-9-13-23)34-45(41,42)35-14-16-44-17-15-35/h5,8-9,12-13,21-22,24-28,34,36-37H,4,6-7,10-11,14-20H2,1-3H3,(H,32,39)(H,33,38)/t24-,25-,26+,27?,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibition of Bovine Cathepsin D.				J Med Chem 34: 1935-43 (1991) BindingDB Entry DOI: 10.7270/Q2NG4R73
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50008127 (2-[3-Phenyl-2-(piperazine-1-sulfonylamino)-propion...) Show SMILES CC[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCNCC1 Show InChI InChI=1S/C34H52F2N6O6S/c1-4-12-27(39-32(45)29(22-26-15-10-7-11-16-26)41-49(47,48)42-19-17-37-18-20-42)31(44)40-28(21-25-13-8-6-9-14-25)30(43)34(35,36)33(46)38-23-24(3)5-2/h4,7,10-11,15-16,24-25,27-29,37,41H,1,5-6,8-9,12-14,17-23H2,2-3H3,(H,38,46)(H,39,45)(H,40,44)/t24-,27-,28-,29-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine Cathepsin D				J Med Chem 35: 2-14 (1992) BindingDB Entry DOI: 10.7270/Q22J6CGV
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50046856 (CHEMBL143902 | [1-(1-{1-[1-Hydroxy-2-(5-hydroxy-pe...) Show SMILES CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCCCCO Show InChI InChI=1S/C30H58N4O7/c1-10-20(5)25(33-28(39)26(21(6)11-2)34-29(40)41-30(7,8)9)27(38)32-22(17-19(3)4)23(36)18-24(37)31-15-13-12-14-16-35/h19-23,25-26,35-36H,10-18H2,1-9H3,(H,31,37)(H,32,38)(H,33,39)(H,34,40)/t20?,21?,22-,23?,25-,26-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50407088 (CHEMBL2112255) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C34H63N3O6/c1-8-23(4)29(32(41)35-26(20-24-15-11-9-12-16-24)30(39)28(38)19-22(2)3)37-31(40)27(21-25-17-13-10-14-18-25)36-33(42)43-34(5,6)7/h22-30,38-39H,8-21H2,1-7H3,(H,35,41)(H,36,42)(H,37,40)/t23-,26-,27-,28-,29-,30+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50368788 (CHEMBL1791112) Show SMILES CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)[C@H](C)CC Show InChI InChI=1S/C30H55N3O7/c1-9-20(5)26(28(37)31-22(16-19(3)4)24(34)18-25(35)39-10-2)33-27(36)23(17-21-14-12-11-13-15-21)32-29(38)40-30(6,7)8/h19-24,26,34H,9-18H2,1-8H3,(H,31,37)(H,32,38)(H,33,36)/t20-,22+,23+,24?,26+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50368795 (CHEMBL1791129) Show SMILES CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)N(C)CC(C)C Show InChI InChI=1S/C30H58N4O6/c1-13-20(7)25(32-28(38)26(21(8)14-2)33-29(39)40-30(9,10)11)27(37)31-22(15-18(3)4)23(35)16-24(36)34(12)17-19(5)6/h18-23,25-26,35H,13-17H2,1-12H3,(H,31,37)(H,32,38)(H,33,39)/t20-,21-,22+,23?,25+,26+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50005425 ((1-{[(Allyl-methyl-amino)-(1-cyclohexylmethyl-2,3-...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)N(C)CC=C Show InChI InChI=1S/C34H56N4O6/c1-8-19-38(7)30(32(42)35-26(21-24-15-11-9-12-16-24)29(40)28(39)20-23(2)3)37-31(41)27(22-25-17-13-10-14-18-25)36-33(43)44-34(4,5)6/h8,10,13-14,17-18,23-24,26-30,39-40H,1,9,11-12,15-16,19-22H2,2-7H3,(H,35,42)(H,36,43)(H,37,41)/t26-,27-,28-,29+,30?/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against bovine cathepsin D				J Med Chem 35: 1032-42 (1992) BindingDB Entry DOI: 10.7270/Q2NG4PKR
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50368802 (CHEMBL1791097) Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)CCC(O)=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C37H55N3O7/c1-5-24(4)34(40-36(46)30(21-25-11-7-6-8-12-25)38-32(42)17-18-33(43)44)37(47)39-29(35(45)31(41)19-23(2)3)22-26-15-16-27-13-9-10-14-28(27)20-26/h9-10,13-16,20,23-25,29-31,34-35,41,45H,5-8,11-12,17-19,21-22H2,1-4H3,(H,38,42)(H,39,47)(H,40,46)(H,43,44)/t24-,29+,30+,31+,34+,35-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50046842 (3-{4-[2-(2-tert-Butoxycarbonylamino-3-methyl-penta...) Show SMILES CCOC(=O)CCNC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)CC)C(C)CC Show InChI InChI=1S/C30H56N4O8/c1-11-19(6)25(33-28(39)26(20(7)12-2)34-29(40)42-30(8,9)10)27(38)32-21(16-18(4)5)22(35)17-23(36)31-15-14-24(37)41-13-3/h18-22,25-26,35H,11-17H2,1-10H3,(H,31,36)(H,32,38)(H,33,39)(H,34,40)/t19?,20?,21-,22?,25-,26-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50407071 (CHEMBL2112257) Show SMILES CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C31H59N3O6/c1-10-20(5)25(33-29(38)26(21(6)11-2)34-30(39)40-31(7,8)9)28(37)32-23(18-22-15-13-12-14-16-22)27(36)24(35)17-19(3)4/h19-27,35-36H,10-18H2,1-9H3,(H,32,37)(H,33,38)(H,34,39)/t20-,21-,23-,24-,25-,26-,27+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50407080 (CHEMBL2112254) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C38H59N3O6/c1-8-25(4)33(41-35(44)31(22-26-14-10-9-11-15-26)40-37(46)47-38(5,6)7)36(45)39-30(34(43)32(42)20-24(2)3)23-27-18-19-28-16-12-13-17-29(28)21-27/h12-13,16-19,21,24-26,30-34,42-43H,8-11,14-15,20,22-23H2,1-7H3,(H,39,45)(H,40,46)(H,41,44)/t25-,30-,31-,32-,33-,34+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50407078 (CHEMBL2112272) Show SMILES CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCC(C)C Show InChI InChI=1S/C29H56N4O6/c1-12-19(7)24(32-27(37)25(20(8)13-2)33-28(38)39-29(9,10)11)26(36)31-21(14-17(3)4)22(34)15-23(35)30-16-18(5)6/h17-22,24-25,34H,12-16H2,1-11H3,(H,30,35)(H,31,36)(H,32,37)(H,33,38)/t19-,20-,21-,22?,24-,25-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50046841 (CHEMBL357864 | Morpholine-4-carboxylic acid {2-cyc...) Show SMILES CCC(C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)N1CCOCC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C38H58N4O6/c1-5-26(4)34(41-36(45)32(23-27-11-7-6-8-12-27)40-38(47)42-17-19-48-20-18-42)37(46)39-31(35(44)33(43)21-25(2)3)24-28-15-16-29-13-9-10-14-30(29)22-28/h9-10,13-16,22,25-27,31-35,43-44H,5-8,11-12,17-21,23-24H2,1-4H3,(H,39,46)(H,40,47)(H,41,45)/t26?,31-,32-,33-,34-,35+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50368814 (CHEMBL1791126) Show SMILES CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCCCCCO Show InChI InChI=1S/C31H60N4O7/c1-10-21(5)26(34-29(40)27(22(6)11-2)35-30(41)42-31(7,8)9)28(39)33-23(18-20(3)4)24(37)19-25(38)32-16-14-12-13-15-17-36/h20-24,26-27,36-37H,10-19H2,1-9H3,(H,32,38)(H,33,39)(H,34,40)(H,35,41)/t21-,22-,23+,24?,26+,27+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibition of onversion of hemoglobin by commercially purchased bovine spleen Cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair

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