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BDBM50403294 CHEMBL305020

SMILES: OC(=O)CN1CCSC[C@H](NC(=O)[C@@H](CS)Cc2ccccc2)C1=O

InChI Key: InChIKey=YKMWSYUXLGCQLN-KGLIPLIRSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50403294   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Neutral Endopeptidase (NEP)


(Rattus norvegicus (Rat))
BDBM50403294
PNG
(CHEMBL305020)
Show SMILES OC(=O)CN1CCSC[C@H](NC(=O)[C@@H](CS)Cc2ccccc2)C1=O
Show InChI InChI=1S/C17H22N2O4S2/c20-15(21)9-19-6-7-25-11-14(17(19)23)18-16(22)13(10-24)8-12-4-2-1-3-5-12/h1-5,13-14,24H,6-11H2,(H,18,22)(H,20,21)/t13-,14+/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 2.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Neutral Endopeptidase isolated from rat kidney.


Bioorg Med Chem Lett 4: 2193-2198 (1994)


Article DOI: 10.1016/S0960-894X(00)80070-0
BindingDB Entry DOI: 10.7270/Q2F47Q9D
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)
BDBM50403294
PNG
(CHEMBL305020)
Show SMILES OC(=O)CN1CCSC[C@H](NC(=O)[C@@H](CS)Cc2ccccc2)C1=O
Show InChI InChI=1S/C17H22N2O4S2/c20-15(21)9-19-6-7-25-11-14(17(19)23)18-16(22)13(10-24)8-12-4-2-1-3-5-12/h1-5,13-14,24H,6-11H2,(H,18,22)(H,20,21)/t13-,14+/m1/s1
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of angiotensin converting enzyme isolated from rat lung.


Bioorg Med Chem Lett 4: 2193-2198 (1994)


Article DOI: 10.1016/S0960-894X(00)80070-0
BindingDB Entry DOI: 10.7270/Q2F47Q9D
More data for this
Ligand-Target Pair