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BDBM50016687 2-(4-Benzyloxy-phenyl)-N-hydroxy-N-methyl-acetamide::CHEMBL54453

SMILES: CN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1

InChI Key: InChIKey=MYMPWMRYZURXNI-UHFFFAOYSA-N

Data: 1 KI  6 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50016687   
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
Cysteinyl leukotriene receptor 1


(GUINEA PIG)
BDBM50016687
PNG
(2-(4-Benzyloxy-phenyl)-N-hydroxy-N-methyl-acetamid...)
Show SMILES CN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H17NO3/c1-17(19)16(18)11-13-7-9-15(10-8-13)20-12-14-5-3-2-4-6-14/h2-10,19H,11-12H2,1H3
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1.00E+5n/an/an/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Activity of the compound to bind against [3H]-LTD4 radioligand in guinea pig


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50016687
PNG
(2-(4-Benzyloxy-phenyl)-N-hydroxy-N-methyl-acetamid...)
Show SMILES CN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H17NO3/c1-17(19)16(18)11-13-7-9-15(10-8-13)20-12-14-5-3-2-4-6-14/h2-10,19H,11-12H2,1H3
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PubMed
n/an/a 100n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
In vitro inhibition of rat polymorphonuclear leukocyte 5-lipoxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair
Cyclooxygenase


(RAT)
BDBM50016687
PNG
(2-(4-Benzyloxy-phenyl)-N-hydroxy-N-methyl-acetamid...)
Show SMILES CN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H17NO3/c1-17(19)16(18)11-13-7-9-15(10-8-13)20-12-14-5-3-2-4-6-14/h2-10,19H,11-12H2,1H3
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n/an/a 9.00E+3n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against rat polymorphonuclear leukocyte cyclooxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016687
PNG
(2-(4-Benzyloxy-phenyl)-N-hydroxy-N-methyl-acetamid...)
Show SMILES CN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H17NO3/c1-17(19)16(18)11-13-7-9-15(10-8-13)20-12-14-5-3-2-4-6-14/h2-10,19H,11-12H2,1H3
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n/an/a 200n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Invitro inhibitory activity against rat platelet 12-lipoxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair
Cyclooxygenase


(RAT)
BDBM50016687
PNG
(2-(4-Benzyloxy-phenyl)-N-hydroxy-N-methyl-acetamid...)
Show SMILES CN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H17NO3/c1-17(19)16(18)11-13-7-9-15(10-8-13)20-12-14-5-3-2-4-6-14/h2-10,19H,11-12H2,1H3
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n/an/a<1.00E+4n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Invitro inhibition of polymorphonuclear leukocyte derived human 5-lipoxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair
Arachidonate 12-lipoxygenase


(Rattus norvegicus)
BDBM50016687
PNG
(2-(4-Benzyloxy-phenyl)-N-hydroxy-N-methyl-acetamid...)
Show SMILES CN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H17NO3/c1-17(19)16(18)11-13-7-9-15(10-8-13)20-12-14-5-3-2-4-6-14/h2-10,19H,11-12H2,1H3
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CHEMBL
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PC sid
UniChem

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PubMed
n/an/a 500n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Invitro inhibition of rat platelet 12-lipoxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016687
PNG
(2-(4-Benzyloxy-phenyl)-N-hydroxy-N-methyl-acetamid...)
Show SMILES CN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C16H17NO3/c1-17(19)16(18)11-13-7-9-15(10-8-13)20-12-14-5-3-2-4-6-14/h2-10,19H,11-12H2,1H3
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PC cid
PC sid
UniChem

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PubMed
n/an/a 300n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Invitro inhibition of polymorphonuclear leukocyte derived human 5-lipoxygenase


J Med Chem 32: 1836-42 (1989)


BindingDB Entry DOI: 10.7270/Q2VT1R21
More data for this
Ligand-Target Pair