Found 7 hits of Enzyme Inhibition Constant Data 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 |
Angiotensin-converting enzyme
(Homo sapiens (Human)) | BDBM50038064
((R)-1-[(S)-2-((S)-2-Amino-hexanoylamino)-propionyl...)Show SMILES CCCC[C@H](N)C(=O)N[C@@H](C)C(=O)N1CCC[C@@H]1C(O)=O Show InChI InChI=1S/C14H25N3O4/c1-3-4-6-10(15)12(18)16-9(2)13(19)17-8-5-7-11(17)14(20)21/h9-11H,3-8,15H2,1-2H3,(H,16,18)(H,20,21)/t9-,10-,11+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Proteus Molecular Design Ltd.
Curated by ChEMBL
| Assay Description Inhibition against ACE. |
J Med Chem 37: 3994-4002 (1994)
BindingDB Entry DOI: 10.7270/Q2XW4HWB |
More data for this Ligand-Target Pair | |
Angiotensin-converting enzyme
(Homo sapiens (Human)) | BDBM50038066
((S)-2-((S)-2-Amino-3-methyl-butyrylamino)-3-(1H-in...)Show SMILES CC(C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O Show InChI InChI=1S/C16H21N3O3/c1-9(2)14(17)15(20)19-13(16(21)22)7-10-8-18-12-6-4-3-5-11(10)12/h3-6,8-9,13-14,18H,7,17H2,1-2H3,(H,19,20)(H,21,22)/t13-,14-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE KEGG MMDB PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Proteus Molecular Design Ltd.
Curated by ChEMBL
| Assay Description Inhibition against ACE. |
J Med Chem 37: 3994-4002 (1994)
BindingDB Entry DOI: 10.7270/Q2XW4HWB |
More data for this Ligand-Target Pair | |
Angiotensin-converting enzyme
(Homo sapiens (Human)) | BDBM50038068
((R)-1-[(S)-2-((S)-2-Amino-4-methyl-pentanoylamino)...)Show SMILES CC(C)C[C@H](N)C(=O)N[C@@H](C)C(=O)N1CCC[C@@H]1C(O)=O Show InChI InChI=1S/C14H25N3O4/c1-8(2)7-10(15)12(18)16-9(3)13(19)17-6-4-5-11(17)14(20)21/h8-11H,4-7,15H2,1-3H3,(H,16,18)(H,20,21)/t9-,10-,11+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Proteus Molecular Design Ltd.
Curated by ChEMBL
| Assay Description Inhibition against ACE. |
J Med Chem 37: 3994-4002 (1994)
BindingDB Entry DOI: 10.7270/Q2XW4HWB |
More data for this Ligand-Target Pair | |
Angiotensin-converting enzyme
(Homo sapiens (Human)) | BDBM50038069
((S)-2-((2S,3S)-2-Amino-3-methyl-pentanoylamino)-3-...)Show SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C15H22N2O4/c1-3-9(2)13(16)14(19)17-12(15(20)21)8-10-4-6-11(18)7-5-10/h4-7,9,12-13,18H,3,8,16H2,1-2H3,(H,17,19)(H,20,21)/t9-,12-,13-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL KEGG PC cid PC sid UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Proteus Molecular Design Ltd.
Curated by ChEMBL
| Assay Description Inhibition against ACE. |
J Med Chem 37: 3994-4002 (1994)
BindingDB Entry DOI: 10.7270/Q2XW4HWB |
More data for this Ligand-Target Pair | |
Angiotensin-converting enzyme
(Homo sapiens (Human)) | BDBM50038065
((R)-1-[(S)-2-((S)-2-Amino-3-phenyl-propionylamino)...)Show SMILES C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N1CCC[C@@H]1C(O)=O Show InChI InChI=1S/C17H23N3O4/c1-11(16(22)20-9-5-8-14(20)17(23)24)19-15(21)13(18)10-12-6-3-2-4-7-12/h2-4,6-7,11,13-14H,5,8-10,18H2,1H3,(H,19,21)(H,23,24)/t11-,13-,14+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 4.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Proteus Molecular Design Ltd.
Curated by ChEMBL
| Assay Description Inhibition against ACE. |
J Med Chem 37: 3994-4002 (1994)
BindingDB Entry DOI: 10.7270/Q2XW4HWB |
More data for this Ligand-Target Pair | |
Angiotensin-converting enzyme
(Homo sapiens (Human)) | BDBM50038070
((R)-1-[(S)-2-((S)-2-Amino-5-guanidino-pentanoylami...)Show SMILES C[C@H](NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(O)=O Show InChI InChI=1S/C14H26N6O4/c1-8(12(22)20-7-3-5-10(20)13(23)24)19-11(21)9(15)4-2-6-18-14(16)17/h8-10H,2-7,15H2,1H3,(H,19,21)(H,23,24)(H4,16,17,18)/t8-,9-,10+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Proteus Molecular Design Ltd.
Curated by ChEMBL
| Assay Description Inhibition against ACE. |
J Med Chem 37: 3994-4002 (1994)
BindingDB Entry DOI: 10.7270/Q2XW4HWB |
More data for this Ligand-Target Pair | |
Angiotensin-converting enzyme
(Homo sapiens (Human)) | BDBM50038067
((R)-1-[(S)-1-((S)-2-Amino-3-phenyl-propionyl)-pyrr...)Show SMILES N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@@H]1C(O)=O Show InChI InChI=1S/C19H25N3O4/c20-14(12-13-6-2-1-3-7-13)17(23)21-10-4-8-15(21)18(24)22-11-5-9-16(22)19(25)26/h1-3,6-7,14-16H,4-5,8-12,20H2,(H,25,26)/t14-,15-,16+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 7.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Proteus Molecular Design Ltd.
Curated by ChEMBL
| Assay Description Inhibition against ACE. |
J Med Chem 37: 3994-4002 (1994)
BindingDB Entry DOI: 10.7270/Q2XW4HWB |
More data for this Ligand-Target Pair | |