BindingDB logo
myBDB logout

PubMed code 1992145

Compile data set for download or QSAR
Found 5 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Angiotensin-converting enzyme


(Rattus norvegicus)
BDBM50011193
PNG
(5-tert-Butyl-3-[2-(1-carboxy-3-phenyl-propylamino)...)
Show SMILES C[C@H](N[C@@H](CCc1ccccc1)C(O)=O)C(=O)N1N=C(S[C@H]1C(O)=O)C(C)(C)C
Show InChI InChI=1S/C20H27N3O5S/c1-12(21-14(17(25)26)11-10-13-8-6-5-7-9-13)15(24)23-16(18(27)28)29-19(22-23)20(2,3)4/h5-9,12,14,16,21H,10-11H2,1-4H3,(H,25,26)(H,27,28)/t12-,14-,16-/m0/s1
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 0.510n/an/an/an/an/an/a



Research and Development Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against angiotensin I converting enzyme


Citation and Details
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)
BDBM50011190
PNG
(5-tert-Butyl-3-[2-(1-carboxy-butylamino)-propionyl...)
Show SMILES CCC[C@H](N[C@@H](C)C(=O)N1N=C(S[C@H]1C(O)=O)C(C)(C)C)C(O)=O
Show InChI InChI=1S/C15H25N3O5S/c1-6-7-9(12(20)21)16-8(2)10(19)18-11(13(22)23)24-14(17-18)15(3,4)5/h8-9,11,16H,6-7H2,1-5H3,(H,20,21)(H,22,23)/t8-,9-,11-/m0/s1
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 0.600n/an/an/an/an/an/a



Research and Development Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against angiotensin I converting enzyme


Citation and Details
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)
BDBM50011191
PNG
(3-[6-Amino-2-(1-carboxy-3-phenyl-propylamino)-hexa...)
Show SMILES CC(C)(C)C1=NN([C@@H](S1)C(O)=O)C(=O)[C@H](CCCCN)N[C@@H](CCc1ccccc1)C(O)=O
Show InChI InChI=1S/C23H34N4O5S/c1-23(2,3)22-26-27(19(33-22)21(31)32)18(28)16(11-7-8-14-24)25-17(20(29)30)13-12-15-9-5-4-6-10-15/h4-6,9-10,16-17,19,25H,7-8,11-14,24H2,1-3H3,(H,29,30)(H,31,32)/t16-,17-,19-/m0/s1
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 0.700n/an/an/an/an/an/a



Research and Development Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against angiotensin I converting enzyme


Citation and Details
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)
BDBM50011192
PNG
((R)-1-[(S)-2-((S)-1-Carboxy-3-phenyl-propylamino)-...)
Show SMILES CC(NC(CCc1ccccc1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H24N2O5/c1-12(16(21)20-11-5-8-15(20)18(24)25)19-14(17(22)23)10-9-13-6-3-2-4-7-13/h2-4,6-7,12,14-15,19H,5,8-11H2,1H3,(H,22,23)(H,24,25)/t12?,14?,15-/m0/s1
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 0.950n/an/an/an/an/an/a



Research and Development Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against angiotensin I converting enzyme


Citation and Details
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)
BDBM50011194
PNG
(3-[2-(1-Carboxy-3-phenyl-propylamino)-propionyl]-5...)
Show SMILES C[C@H](N[C@@H](CCc1ccccc1)C(O)=O)C(=O)N1N=C(S[C@H]1C(O)=O)c1ccccc1
Show InChI InChI=1S/C22H23N3O5S/c1-14(23-17(21(27)28)13-12-15-8-4-2-5-9-15)19(26)25-20(22(29)30)31-18(24-25)16-10-6-3-7-11-16/h2-11,14,17,20,23H,12-13H2,1H3,(H,27,28)(H,29,30)/t14-,17-,20-/m0/s1
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 1.5n/an/an/an/an/an/a



Research and Development Laboratories

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity against angiotensin I converting enzyme


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%