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BDBM50077667 (3R,4R)-4-[4-(4-Benzyloxy-butoxy)-phenyl]-3-(naphthalen-2-ylmethoxy)-piperidine::CHEMBL418034

SMILES: C(CCOc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2ccccc2c1)COCc1ccccc1

InChI Key: InChIKey=VWNFECAXKISCQZ-SAIUNTKASA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50077667   
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))
BDBM50077667
PNG
((3R,4R)-4-[4-(4-Benzyloxy-butoxy)-phenyl]-3-(napht...)
Show SMILES C(CCOc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2ccccc2c1)COCc1ccccc1
Show InChI InChI=1S/C33H37NO3/c1-2-8-26(9-3-1)24-35-20-6-7-21-36-31-16-14-29(15-17-31)32-18-19-34-23-33(32)37-25-27-12-13-28-10-4-5-11-30(28)22-27/h1-5,8-17,22,32-34H,6-7,18-21,23-25H2/t32-,33+/m1/s1
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Similars

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



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against purified recombinant human renin


Bioorg Med Chem Lett 9: 1397-402 (1999)


Article DOI: 10.1016/s0960-894x(99)00195-x
BindingDB Entry DOI: 10.7270/Q24F1PWN
More data for this
Ligand-Target Pair