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BDBM50085306 CHEMBL164168::[2-(4-Benzyl-phenoxy)-ethyl]-diisopropyl-amine

SMILES: CC(C)N(CCOc1ccc(Cc2ccccc2)cc1)C(C)C

InChI Key: InChIKey=VENAHOHBXAUADX-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50085306   
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
Leukotriene A4 hydrolase


(Homo sapiens (Human))
BDBM50085306
PNG
(CHEMBL164168 | [2-(4-Benzyl-phenoxy)-ethyl]-diisop...)
Show SMILES CC(C)N(CCOc1ccc(Cc2ccccc2)cc1)C(C)C
Show InChI InChI=1S/C21H29NO/c1-17(2)22(18(3)4)14-15-23-21-12-10-20(11-13-21)16-19-8-6-5-7-9-19/h5-13,17-18H,14-16H2,1-4H3
PDB
MMDB

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PC cid
PC sid
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Similars

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



Searle Research and Development

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against Leukotriene A4 hydrolase


J Med Chem 43: 721-35 (2000)


BindingDB Entry DOI: 10.7270/Q2CN74MZ
More data for this
Ligand-Target Pair
Leukotriene A4 hydrolase


(Homo sapiens (Human))
BDBM50085306
PNG
(CHEMBL164168 | [2-(4-Benzyl-phenoxy)-ethyl]-diisop...)
Show SMILES CC(C)N(CCOc1ccc(Cc2ccccc2)cc1)C(C)C
Show InChI InChI=1S/C21H29NO/c1-17(2)22(18(3)4)14-15-23-21-12-10-20(11-13-21)16-19-8-6-5-7-9-19/h5-13,17-18H,14-16H2,1-4H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 140n/an/an/an/an/an/a



Searle Research and Development

Curated by ChEMBL


Assay Description
Inhibitory activity was determined for LTB4 production in human whole blood.


J Med Chem 43: 721-35 (2000)


BindingDB Entry DOI: 10.7270/Q2CN74MZ
More data for this
Ligand-Target Pair