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BDBM50352914 CHEMBL1824638

SMILES: Cc1c(F)cccc1Oc1c(C(=O)N2CCNCC2)c2cnccc2n1-c1ccccc1

InChI Key: InChIKey=MPYQQGSSQREHPC-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50352914   
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
Renin


(Homo sapiens (Human))
BDBM50352914
PNG
(CHEMBL1824638)
Show SMILES Cc1c(F)cccc1Oc1c(C(=O)N2CCNCC2)c2cnccc2n1-c1ccccc1
Show InChI InChI=1S/C25H23FN4O2/c1-17-20(26)8-5-9-22(17)32-25-23(24(31)29-14-12-27-13-15-29)19-16-28-11-10-21(19)30(25)18-6-3-2-4-7-18/h2-11,16,27H,12-15H2,1H3
PDB
MMDB

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Similars

Article
PubMed
n/an/a 181n/an/an/an/an/an/a



Sanofi-Aventis Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibition of recombinant human renin using Dabcyl-gamma-Abu-Ile-His-Pro-Phe-His-Leu-Val-Ile-His-Thr-EDANS as substrate after 2 hrs by spectrofluorom...


Bioorg Med Chem Lett 21: 5487-92 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.112
BindingDB Entry DOI: 10.7270/Q2RX9CFJ
More data for this
Ligand-Target Pair