BDBM50373666 CHEMBL271718
SMILES: O[C@@H](CN(CCN1C(=O)c2cccc3cccc(C1=O)c23)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(O)=O)C(O)=O
InChI Key: InChIKey=GHAAEYINJLFABM-DQEYMECFSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50373666 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 |
|---|
Neprilysin
(Homo sapiens (Human)) | BDBM50373666
(CHEMBL271718)Show SMILES O[C@@H](CN(CCN1C(=O)c2cccc3cccc(C1=O)c23)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(O)=O)C(O)=O Show InChI InChI=1S/C31H27N3O8/c35-25(30(40)41)17-33(13-14-34-27(36)22-9-3-7-20-8-4-10-23(26(20)22)28(34)37)31(42)32-24(29(38)39)16-18-11-12-19-5-1-2-6-21(19)15-18/h1-12,15,24-25,35H,13-14,16-17H2,(H,32,42)(H,38,39)(H,40,41)/t24-,25-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 650 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description
Inhibition of NEP |
Bioorg Med Chem Lett 18: 1058-62 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.013
BindingDB Entry DOI: 10.7270/Q23N2483 |
More data for this
Ligand-Target Pair | |
Angiotensin-converting enzyme
(Homo sapiens (Human)) | BDBM50373666
(CHEMBL271718)Show SMILES O[C@@H](CN(CCN1C(=O)c2cccc3cccc(C1=O)c23)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(O)=O)C(O)=O Show InChI InChI=1S/C31H27N3O8/c35-25(30(40)41)17-33(13-14-34-27(36)22-9-3-7-20-8-4-10-23(26(20)22)28(34)37)31(42)32-24(29(38)39)16-18-11-12-19-5-1-2-6-21(19)15-18/h1-12,15,24-25,35H,13-14,16-17H2,(H,32,42)(H,38,39)(H,40,41)/t24-,25-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description
Inhibition of ACE |
Bioorg Med Chem Lett 18: 1058-62 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.013
BindingDB Entry DOI: 10.7270/Q23N2483 |
More data for this
Ligand-Target Pair | |
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