Found 6 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
(Oryctolagus cuniculus) | BDBM21642
((2S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]pyrrolid...)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
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| Purchase
CHEMBL
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibitory concentration against angiotensin converting enzyme (ACE) |
Bioorg Med Chem Lett 4: 2799-2804 (1994)
Article DOI: 10.1016/S0960-894X(01)80597-7
BindingDB Entry DOI: 10.7270/Q2NP24XX |
More data for this
Ligand-Target Pair | |
Angiotensin-converting enzyme
(Oryctolagus cuniculus) | BDBM50283770
((S)-1-((2R,5S)-5-Benzoylamino-2-hydroxy-4-oxo-6-ph...)Show SMILES O[C@H](CC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)N1[C@@H](Cc2ccccc12)C(O)=O Show InChI InChI=1S/C28H26N2O6/c31-24(17-25(32)27(34)30-22-14-8-7-13-20(22)16-23(30)28(35)36)21(15-18-9-3-1-4-10-18)29-26(33)19-11-5-2-6-12-19/h1-14,21,23,25,32H,15-17H2,(H,29,33)(H,35,36)/t21-,23-,25+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibitory concentration against angiotensin converting enzyme (ACE) |
Bioorg Med Chem Lett 4: 2799-2804 (1994)
Article DOI: 10.1016/S0960-894X(01)80597-7
BindingDB Entry DOI: 10.7270/Q2NP24XX |
More data for this
Ligand-Target Pair | |
Angiotensin-converting enzyme
(Oryctolagus cuniculus) | BDBM50283769
((S)-1-((2R,5S)-5-Benzoylamino-2-hydroxy-4-oxo-6-ph...)Show SMILES O[C@H](CC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(O)=O Show InChI InChI=1S/C24H26N2O6/c27-20(15-21(28)23(30)26-13-7-12-19(26)24(31)32)18(14-16-8-3-1-4-9-16)25-22(29)17-10-5-2-6-11-17/h1-6,8-11,18-19,21,28H,7,12-15H2,(H,25,29)(H,31,32)/t18-,19-,21+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibitory concentration against angiotensin converting enzyme (ACE) |
Bioorg Med Chem Lett 4: 2799-2804 (1994)
Article DOI: 10.1016/S0960-894X(01)80597-7
BindingDB Entry DOI: 10.7270/Q2NP24XX |
More data for this
Ligand-Target Pair | |
Angiotensin-converting enzyme
(Oryctolagus cuniculus) | BDBM50283768
((S)-1-((2S,5S)-5-Benzoylamino-2-hydroxy-4-oxo-6-ph...)Show SMILES O[C@@H](CC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)N1[C@@H](Cc2ccccc12)C(O)=O Show InChI InChI=1S/C28H26N2O6/c31-24(17-25(32)27(34)30-22-14-8-7-13-20(22)16-23(30)28(35)36)21(15-18-9-3-1-4-10-18)29-26(33)19-11-5-2-6-12-19/h1-14,21,23,25,32H,15-17H2,(H,29,33)(H,35,36)/t21-,23-,25-/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibitory concentration against angiotensin converting enzyme (ACE) |
Bioorg Med Chem Lett 4: 2799-2804 (1994)
Article DOI: 10.1016/S0960-894X(01)80597-7
BindingDB Entry DOI: 10.7270/Q2NP24XX |
More data for this
Ligand-Target Pair | |
Angiotensin-converting enzyme
(Oryctolagus cuniculus) | BDBM50283772
((S)-1-((2S,5S)-5-Benzoylamino-2-hydroxy-4-oxo-6-ph...)Show SMILES O[C@@H](CC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(O)=O Show InChI InChI=1S/C24H26N2O6/c27-20(15-21(28)23(30)26-13-7-12-19(26)24(31)32)18(14-16-8-3-1-4-9-16)25-22(29)17-10-5-2-6-11-17/h1-6,8-11,18-19,21,28H,7,12-15H2,(H,25,29)(H,31,32)/t18-,19-,21-/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibitory concentration against angiotensin converting enzyme (ACE) |
Bioorg Med Chem Lett 4: 2799-2804 (1994)
Article DOI: 10.1016/S0960-894X(01)80597-7
BindingDB Entry DOI: 10.7270/Q2NP24XX |
More data for this
Ligand-Target Pair | |
Angiotensin-converting enzyme
(Oryctolagus cuniculus) | BDBM50283771
((S)-1-[(R)-3-((S)-1-Benzoylamino-2-phenyl-ethyl)-4...)Show SMILES OC(=O)[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CC(=NO1)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 |c:18| Show InChI InChI=1S/C28H25N3O5/c32-26(19-11-5-2-6-12-19)29-21(15-18-9-3-1-4-10-18)22-17-25(36-30-22)27(33)31-23-14-8-7-13-20(23)16-24(31)28(34)35/h1-14,21,24-25H,15-17H2,(H,29,32)(H,34,35)/t21-,24-,25+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
| n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibitory concentration against angiotensin converting enzyme (ACE) |
Bioorg Med Chem Lett 4: 2799-2804 (1994)
Article DOI: 10.1016/S0960-894X(01)80597-7
BindingDB Entry DOI: 10.7270/Q2NP24XX |
More data for this
Ligand-Target Pair | |
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