Compile Data Set for Download or QSAR

Found 73 hits with Last Name = 'di bugno' and Initial = 'c'   

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
Substance-K receptor (Homo sapiens (Human))	BDBM50472916 (CHEMBL223221 | MEN-11690) Show SMILES Clc1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1Cl |r| Show InChI InChI=1S/C33H33Cl2N5O4/c34-25-11-10-21(15-26(25)35)14-23-19-37-30(41)12-13-31(42)39-29(17-22-18-36-27-9-5-4-8-24(22)27)33(44)40-28(32(43)38-23)16-20-6-2-1-3-7-20/h1-11,15,18,23,28-29,36H,12-14,16-17,19H2,(H,37,41)(H,38,43)(H,39,42)(H,40,44)/t23-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50366377 (CHEMBL334721 | MEN-10627) Show SMILES CSCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]2CNC(=O)C[C@H](NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 Show InChI InChI=1S/C38H48N8O7S/c1-21(2)15-27-34(49)41-26(13-14-54-3)33(48)45-30-18-32(47)40-20-31(38(53)42-27)46-35(50)28(16-22-9-5-4-6-10-22)43-36(51)29(44-37(30)52)17-23-19-39-25-12-8-7-11-24(23)25/h4-12,19,21,26-31,39H,13-18,20H2,1-3H3,(H,40,47)(H,41,49)(H,42,53)(H,43,51)(H,44,52)(H,45,48)(H,46,50)/t26-,27-,28-,29-,30-,31-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472917 (CHEMBL323884 | MEN-11749) Show SMILES Fc1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1F Show InChI InChI=1S/C33H33F2N5O4/c34-25-11-10-21(15-26(25)35)14-23-19-37-30(41)12-13-31(42)39-29(17-22-18-36-27-9-5-4-8-24(22)27)33(44)40-28(32(43)38-23)16-20-6-2-1-3-7-20/h1-11,15,18,23,28-29,36H,12-14,16-17,19H2,(H,37,41)(H,38,43)(H,39,42)(H,40,44)/t23-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50404020 (CHEMBL435324 | MEN-11558) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CN1 |r| Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472911 (CHEMBL407782 | MEN-11420) Show SMILES [H][C@]12CNC(=O)C[C@]([H])(NC(=O)[C@H](CC(=O)N[C@@H]3O[C@H](CO)[C@@H](O)[C@H](CO)[C@H]3NC(C)=O)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 Show InChI InChI=1S/C46H60N10O13/c1-22(2)13-29-40(63)54-33(17-37(61)56-46-38(49-23(3)59)27(20-57)39(62)35(21-58)69-46)44(67)53-32-16-36(60)48-19-34(45(68)50-29)55-41(64)30(14-24-9-5-4-6-10-24)51-42(65)31(52-43(32)66)15-25-18-47-28-12-8-7-11-26(25)28/h4-12,18,22,27,29-35,38-39,46-47,57-58,62H,13-17,19-21H2,1-3H3,(H,48,60)(H,49,59)(H,50,68)(H,51,65)(H,52,66)(H,53,67)(H,54,63)(H,55,64)(H,56,61)/t27-,29+,30+,31+,32+,33+,34+,35-,38-,39+,46-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472912 (CHEMBL116564 | MEN-11712) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)CN1 Show InChI InChI=1S/C37H37N5O4/c43-34-16-17-35(44)41-33(21-28-22-38-31-13-7-6-12-30(28)31)37(46)42-32(20-24-8-2-1-3-9-24)36(45)40-29(23-39-34)19-25-14-15-26-10-4-5-11-27(26)18-25/h1-15,18,22,29,32-33,38H,16-17,19-21,23H2,(H,39,43)(H,40,45)(H,41,44)(H,42,46)/t29-,32+,33+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472910 (CHEMBL263194) Show SMILES COc1ccc(CC2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1 Show InChI InChI=1S/C34H37N5O5/c1-44-26-13-11-23(12-14-26)17-25-21-36-31(40)15-16-32(41)38-30(19-24-20-35-28-10-6-5-9-27(24)28)34(43)39-29(33(42)37-25)18-22-7-3-2-4-8-22/h2-14,20,25,29-30,35H,15-19,21H2,1H3,(H,36,40)(H,37,42)(H,38,41)(H,39,43)/t25?,29-,30-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472908 (CHEMBL336053) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCc2ccccc2)CN1 Show InChI InChI=1S/C34H37N5O4/c40-31-17-18-32(41)38-30(20-25-21-35-28-14-8-7-13-27(25)28)34(43)39-29(19-24-11-5-2-6-12-24)33(42)37-26(22-36-31)16-15-23-9-3-1-4-10-23/h1-14,21,26,29-30,35H,15-20,22H2,(H,36,40)(H,37,42)(H,38,41)(H,39,43)/t26-,29+,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472913 (CHEMBL2112675) Show SMILES FC(F)(F)c1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1 Show InChI InChI=1S/C34H34F3N5O4/c35-34(36,37)24-12-10-22(11-13-24)16-25-20-39-30(43)14-15-31(44)41-29(18-23-19-38-27-9-5-4-8-26(23)27)33(46)42-28(32(45)40-25)17-21-6-2-1-3-7-21/h1-13,19,25,28-29,38H,14-18,20H2,(H,39,43)(H,40,45)(H,41,44)(H,42,46)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472914 (CHEMBL114442 | MEN-11667) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CC2CCCCC2)CN1 Show InChI InChI=1S/C33H41N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h2,5-8,11-14,20,22,25,28-29,34H,1,3-4,9-10,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472919 (CHEMBL337628) Show SMILES O=C1CC(Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCN1 Show InChI InChI=1S/C33H35N5O4/c39-30-20-24(17-22-9-3-1-4-10-22)31(40)37-29(19-25-21-36-27-14-8-7-13-26(25)27)33(42)38-28(32(41)35-16-15-34-30)18-23-11-5-2-6-12-23/h1-14,21,24,28-29,36H,15-20H2,(H,34,39)(H,35,41)(H,37,40)(H,38,42)/t24?,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472915 (CHEMBL114036 | MEN-11540) Show SMILES O=C1CC(Cc2ccccc2)C(=O)NCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 Show InChI InChI=1S/C33H35N5O4/c39-30-20-24(17-22-9-3-1-4-10-22)31(40)34-15-16-35-32(41)28(18-23-11-5-2-6-12-23)38-33(42)29(37-30)19-25-21-36-27-14-8-7-13-26(25)27/h1-14,21,24,28-29,36H,15-20H2,(H,34,40)(H,35,41)(H,37,39)(H,38,42)/t24?,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472918 (CHEMBL324804 | MEN-11970) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCN1 Show InChI InChI=1S/C26H29N5O4/c32-23-10-11-24(33)30-22(15-18-16-29-20-9-5-4-8-19(18)20)26(35)31-21(25(34)28-13-12-27-23)14-17-6-2-1-3-7-17/h1-9,16,21-22,29H,10-15H2,(H,27,32)(H,28,34)(H,30,33)(H,31,35)/t21-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472906 (CHEMBL2111858) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NC[C@H](Cc2ccccc2)N1 Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)35-21-25(36-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,41)(H,36,39)(H,37,40)(H,38,42)/t25-,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472907 (CHEMBL131024) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NC(Cc2ccccc2)CN1 Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25?,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472909 (CHEMBL2112669) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NC[C@@H](Cc2ccccc2)N1 Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)35-21-25(36-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,41)(H,36,39)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM21642 ((2S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]pyrrolid...) Show SMILES C[C@H](CS)C(=O)N1CCC[C@H]1C(O)=O Show InChI InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046641 (1R,2R-trans-2-(Ethyl-hydroxycarbamoylmethyl-carbam...) Show SMILES CCN(CC(=O)NO)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C12H20N2O5/c1-2-14(7-10(15)13-19)11(16)8-5-3-4-6-9(8)12(17)18/h8-9,19H,2-7H2,1H3,(H,13,15)(H,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50070307 ((1R,2S)-2-(2-Methylamino-3-naphthalen-2-yl-propion...) Show SMILES CNC(Cc1ccc2ccccc2c1)C(=O)N[C@H]1CCCC[C@H]1C(=O)N[C@H](CCCNC(N)=N)C=O Show InChI InChI=1S/C27H38N6O3/c1-30-24(16-18-12-13-19-7-2-3-8-20(19)15-18)26(36)33-23-11-5-4-10-22(23)25(35)32-21(17-34)9-6-14-31-27(28)29/h2-3,7-8,12-13,15,17,21-24,30H,4-6,9-11,14,16H2,1H3,(H,32,35)(H,33,36)(H4,28,29,31)/t21-,22-,23+,24?/m1/s1	PDB UniProtKB/SwissProt antibodypedia 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
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of thrombin using the synthetic substrate chromozym TH				Bioorg Med Chem Lett 8: 1249-54 (1999) BindingDB Entry DOI: 10.7270/Q2FF3RH3
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046633 (1R,2R-trans-2-(Hydroxycarbamoylmethyl-methyl-carba...) Show SMILES CN(CC(=O)NO)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C11H18N2O5/c1-13(6-9(14)12-18)10(15)7-4-2-3-5-8(7)11(16)17/h7-8,18H,2-6H2,1H3,(H,12,14)(H,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046633 (1R,2R-trans-2-(Hydroxycarbamoylmethyl-methyl-carba...) Show SMILES CN(CC(=O)NO)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C11H18N2O5/c1-13(6-9(14)12-18)10(15)7-4-2-3-5-8(7)11(16)17/h7-8,18H,2-6H2,1H3,(H,12,14)(H,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50228863 ((S)-1-((R)-2-Methylamino-3-phenyl-propionyl)-pyrro...) Show SMILES [#6]-[#7]-[#6@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6]=O Show InChI InChI=1S/C21H32N6O3/c1-24-17(13-15-7-3-2-4-8-15)20(30)27-12-6-10-18(27)19(29)26-16(14-28)9-5-11-25-21(22)23/h2-4,7-8,14,16-18,24H,5-6,9-13H2,1H3,(H,26,29)(H4,22,23,25)/t16-,17+,18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of thrombin using the synthetic substrate chromozym TH				Bioorg Med Chem Lett 8: 1249-54 (1999) BindingDB Entry DOI: 10.7270/Q2FF3RH3
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046632 (CHEMBL159829 | Cis-2-(Hydroxycarbamoylmethyl-propy...) Show SMILES CCCN(CC(=O)NO)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C13H22N2O5/c1-2-7-15(8-11(16)14-20)12(17)9-5-3-4-6-10(9)13(18)19/h9-10,20H,2-8H2,1H3,(H,14,16)(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046632 (CHEMBL159829 | Cis-2-(Hydroxycarbamoylmethyl-propy...) Show SMILES CCCN(CC(=O)NO)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C13H22N2O5/c1-2-7-15(8-11(16)14-20)12(17)9-5-3-4-6-10(9)13(18)19/h9-10,20H,2-8H2,1H3,(H,14,16)(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046621 (CHEMBL352453 | Trans-2-(Hydroxycarbamoylmethyl-iso...) Show SMILES CC(C)N(CC(=O)NO)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C13H22N2O5/c1-8(2)15(7-11(16)14-20)12(17)9-5-3-4-6-10(9)13(18)19/h8-10,20H,3-7H2,1-2H3,(H,14,16)(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046629 (1-(3-Hydroxycarbamoyl-2-methyl-propionyl)-pyrrolid...) Show SMILES CC(CC(=O)NO)C(=O)N1CCC[C@H]1C(O)=O Show InChI InChI=1S/C10H16N2O5/c1-6(5-8(13)11-17)9(14)12-4-2-3-7(12)10(15)16/h6-7,17H,2-5H2,1H3,(H,11,13)(H,15,16)/t6?,7-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046628 (CHEMBL434293 | Trans-2-(Hydroxycarbamoylmethyl-met...) Show SMILES CN(CC(=O)NO)C(=O)C1CCCC1C(O)=O Show InChI InChI=1S/C10H16N2O5/c1-12(5-8(13)11-17)9(14)6-3-2-4-7(6)10(15)16/h6-7,17H,2-5H2,1H3,(H,11,13)(H,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046631 (CHEMBL159791 | Cis-2-(3-Mercapto-propionyl)-cycloh...) Show SMILES OC(=O)C1CCCCC1C(=O)CCS Show InChI InChI=1S/C10H16O3S/c11-9(5-6-14)7-3-1-2-4-8(7)10(12)13/h7-8,14H,1-6H2,(H,12,13)	PDB KEGG UniProtKB/SwissProt B.MOAD 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
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046631 (CHEMBL159791 | Cis-2-(3-Mercapto-propionyl)-cycloh...) Show SMILES OC(=O)C1CCCCC1C(=O)CCS Show InChI InChI=1S/C10H16O3S/c11-9(5-6-14)7-3-1-2-4-8(7)10(12)13/h7-8,14H,1-6H2,(H,12,13)	PDB KEGG UniProtKB/SwissProt B.MOAD 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
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046641 (1R,2R-trans-2-(Ethyl-hydroxycarbamoylmethyl-carbam...) Show SMILES CCN(CC(=O)NO)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C12H20N2O5/c1-2-14(7-10(15)13-19)11(16)8-5-3-4-6-9(8)12(17)18/h8-9,19H,2-7H2,1H3,(H,13,15)(H,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046634 (CHEMBL161968 | Cis-2-(Hydroxycarbamoylmethyl-carba...) Show SMILES ONC(=O)CNC(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C10H16N2O5/c13-8(12-17)5-11-9(14)6-3-1-2-4-7(6)10(15)16/h6-7,17H,1-5H2,(H,11,14)(H,12,13)(H,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046634 (CHEMBL161968 | Cis-2-(Hydroxycarbamoylmethyl-carba...) Show SMILES ONC(=O)CNC(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C10H16N2O5/c13-8(12-17)5-11-9(14)6-3-1-2-4-7(6)10(15)16/h6-7,17H,1-5H2,(H,11,14)(H,12,13)(H,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50070306 ((1R,2R)-2-(2-Methylamino-3-phenyl-propionylamino)-...) Show SMILES CNC(Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1C(=O)N[C@H](CCCNC(N)=N)C=O Show InChI InChI=1S/C23H36N6O3/c1-26-20(14-16-8-3-2-4-9-16)22(32)29-19-12-6-5-11-18(19)21(31)28-17(15-30)10-7-13-27-23(24)25/h2-4,8-9,15,17-20,26H,5-7,10-14H2,1H3,(H,28,31)(H,29,32)(H4,24,25,27)/t17-,18-,19-,20?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of thrombin using the synthetic substrate chromozym TH				Bioorg Med Chem Lett 8: 1249-54 (1999) BindingDB Entry DOI: 10.7270/Q2FF3RH3
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046638 (CHEMBL163601 | Cis-2-(2-Mercapto-ethylcarbamoyl)-c...) Show SMILES OC(=O)C1CCCC1C(=O)NCCS Show InChI InChI=1S/C9H15NO3S/c11-8(10-4-5-14)6-2-1-3-7(6)9(12)13/h6-7,14H,1-5H2,(H,10,11)(H,12,13)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50070305 ((1R,2S)-Cyclohexane-1,2-dicarboxylic acid 1-[((R)-...) Show SMILES CN(CCc1ccccc1)C(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H](CCCNC(N)=N)C=O Show InChI InChI=1S/C23H35N5O3/c1-28(15-13-17-8-3-2-4-9-17)22(31)20-12-6-5-11-19(20)21(30)27-18(16-29)10-7-14-26-23(24)25/h2-4,8-9,16,18-20H,5-7,10-15H2,1H3,(H,27,30)(H4,24,25,26)/t18-,19+,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of thrombin using the synthetic substrate chromozym TH				Bioorg Med Chem Lett 8: 1249-54 (1999) BindingDB Entry DOI: 10.7270/Q2FF3RH3
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046630 (1-(3-Carboxy-butyryl)-pyrrolidine-2-carboxylic aci...) Show SMILES C[C@H](CC(=O)N1CCCC1C(O)=O)C(O)=O Show InChI InChI=1S/C10H15NO5/c1-6(9(13)14)5-8(12)11-4-2-3-7(11)10(15)16/h6-7H,2-5H2,1H3,(H,13,14)(H,15,16)/t6-,7?/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046626 (CHEMBL163568 | Cis-2-(Carboxymethyl-ethyl-carbamoy...) Show SMILES CCN(CC(O)=O)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C12H19NO5/c1-2-13(7-10(14)15)11(16)8-5-3-4-6-9(8)12(17)18/h8-9H,2-7H2,1H3,(H,14,15)(H,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD 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
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046626 (CHEMBL163568 | Cis-2-(Carboxymethyl-ethyl-carbamoy...) Show SMILES CCN(CC(O)=O)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C12H19NO5/c1-2-13(7-10(14)15)11(16)8-5-3-4-6-9(8)12(17)18/h8-9H,2-7H2,1H3,(H,14,15)(H,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD 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
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50070304 (CHEMBL281784 | Cyclohexane-1,2-dicarboxylic acid 1...) Show SMILES CN(CCc1ccccc1)C(=O)C1CCCCC1C(=O)N[C@H](CCCNC(N)=N)C=O Show InChI InChI=1S/C23H35N5O3/c1-28(15-13-17-8-3-2-4-9-17)22(31)20-12-6-5-11-19(20)21(30)27-18(16-29)10-7-14-26-23(24)25/h2-4,8-9,16,18-20H,5-7,10-15H2,1H3,(H,27,30)(H4,24,25,26)/t18-,19?,20?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of thrombin using the synthetic substrate chromozym TH				Bioorg Med Chem Lett 8: 1249-54 (1999) BindingDB Entry DOI: 10.7270/Q2FF3RH3
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046636 (CHEMBL159996 | Cis-2-[(Benzyloxycarbamoyl-methyl)-...) Show SMILES OC(=O)C1CCCCC1C(=O)NCC(=O)NOCc1ccccc1 Show InChI InChI=1S/C17H22N2O5/c20-15(19-24-11-12-6-2-1-3-7-12)10-18-16(21)13-8-4-5-9-14(13)17(22)23/h1-3,6-7,13-14H,4-5,8-11H2,(H,18,21)(H,19,20)(H,22,23)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046640 (CHEMBL163549 | Cis-2-(2-Mercapto-ethylcarbamoyl)-c...) Show SMILES OC(=O)C1CCCCC1C(=O)NCCS Show InChI InChI=1S/C10H17NO3S/c12-9(11-5-6-15)7-3-1-2-4-8(7)10(13)14/h7-8,15H,1-6H2,(H,11,12)(H,13,14)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046627 (CHEMBL161552 | Cis-2-[(Benzyloxycarbamoyl-methyl)-...) Show SMILES CCN(CC(=O)NOCc1ccccc1)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C19H26N2O5/c1-2-21(18(23)15-10-6-7-11-16(15)19(24)25)12-17(22)20-26-13-14-8-4-3-5-9-14/h3-5,8-9,15-16H,2,6-7,10-13H2,1H3,(H,20,22)(H,24,25)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046636 (CHEMBL159996 | Cis-2-[(Benzyloxycarbamoyl-methyl)-...) Show SMILES OC(=O)C1CCCCC1C(=O)NCC(=O)NOCc1ccccc1 Show InChI InChI=1S/C17H22N2O5/c20-15(19-24-11-12-6-2-1-3-7-12)10-18-16(21)13-8-4-5-9-14(13)17(22)23/h1-3,6-7,13-14H,4-5,8-11H2,(H,18,21)(H,19,20)(H,22,23)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046640 (CHEMBL163549 | Cis-2-(2-Mercapto-ethylcarbamoyl)-c...) Show SMILES OC(=O)C1CCCCC1C(=O)NCCS Show InChI InChI=1S/C10H17NO3S/c12-9(11-5-6-15)7-3-1-2-4-8(7)10(13)14/h7-8,15H,1-6H2,(H,11,12)(H,13,14)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046627 (CHEMBL161552 | Cis-2-[(Benzyloxycarbamoyl-methyl)-...) Show SMILES CCN(CC(=O)NOCc1ccccc1)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C19H26N2O5/c1-2-21(18(23)15-10-6-7-11-16(15)19(24)25)12-17(22)20-26-13-14-8-4-3-5-9-14/h3-5,8-9,15-16H,2,6-7,10-13H2,1H3,(H,20,22)(H,24,25)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046624 (1R,2R-trans-2-[(Benzoyloxycarbamoyl-methyl)-ethyl-...) Show SMILES CCN(CC(=O)NOC(=O)c1ccccc1)C(=O)[C@@H]1CCCC[C@@H]1C(O)=O Show InChI InChI=1S/C19H24N2O6/c1-2-21(17(23)14-10-6-7-11-15(14)18(24)25)12-16(22)20-27-19(26)13-8-4-3-5-9-13/h3-5,8-9,14-15H,2,6-7,10-12H2,1H3,(H,20,22)(H,24,25)/t14-,15+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046620 (CHEMBL159956 | Cis-2-[(Benzyloxycarbamoyl-methyl)-...) Show SMILES CN(CC(=O)NOCc1ccccc1)C(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C18H24N2O5/c1-20(17(22)14-9-5-6-10-15(14)18(23)24)11-16(21)19-25-12-13-7-3-2-4-8-13/h2-4,7-8,14-15H,5-6,9-12H2,1H3,(H,19,21)(H,23,24)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046625 (1R,2R-trans-2-[(Benzoyloxycarbamoyl-methyl)-carbam...) Show SMILES CN(CC(=O)NOC(=O)c1ccccc1)C(=O)[C@@H]1CCCC[C@@H]1C(O)=O Show InChI InChI=1S/C18H22N2O6/c1-20(16(22)13-9-5-6-10-14(13)17(23)24)11-15(21)19-26-18(25)12-7-3-2-4-8-12/h2-4,7-8,13-14H,5-6,9-11H2,1H3,(H,19,21)(H,23,24)/t13-,14+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046622 (CHEMBL159995 | Trans-2-[(Benzyloxycarbamoyl-methyl...) Show SMILES CN(CC(=O)NOCc1ccccc1)C(=O)C1CCCC1C(O)=O Show InChI InChI=1S/C17H22N2O5/c1-19(16(21)13-8-5-9-14(13)17(22)23)10-15(20)18-24-11-12-6-3-2-4-7-12/h2-4,6-7,13-14H,5,8-11H2,1H3,(H,18,20)(H,22,23)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50046635 (CHEMBL159973 | Cis-2-(Carboxymethyl-carbamoyl)-cyc...) Show SMILES OC(=O)CNC(=O)C1CCCCC1C(O)=O Show InChI InChI=1S/C10H15NO5/c12-8(13)5-11-9(14)6-3-1-2-4-7(6)10(15)16/h6-7H,1-5H2,(H,11,14)(H,12,13)(H,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Laboratori Guidotti S.p.A. Curated by ChEMBL					Assay Description In vitro inhibitory activity against rat serum angiotensin I converting enzyme using hippuryl-glycyl-glycine as substrate				J Med Chem 36: 699-707 (1993) BindingDB Entry DOI: 10.7270/Q21N81RS
					More data for this Ligand-Target Pair

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