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BDBM50036743 CHEMBL60617::Sodium salt of 4-Ethyl-5-[6-methyl-6-(2H-tetrazol-5-yl)-heptyloxy]-2-propyl-phenol::sodium 4-ethyl-5-[6-methyl-6-(2H-1,2,3,4-tetraazol-5-yl)heptyloxy]-2-propylphenol

SMILES: CCCc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O

InChI Key: InChIKey=QMCAVHVILYVLFD-UHFFFAOYSA-N

Data: 3 KI  3 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 6 hits for monomerid = 50036743   
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 B4 receptor


(Homo sapiens (Human))
BDBM50036743
PNG
(CHEMBL60617 | Sodium salt of 4-Ethyl-5-[6-methyl-6...)
Show SMILES CCCc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O
Show InChI InChI=1S/C20H31N4O2/c1-5-10-16-13-15(6-2)18(14-17(16)25)26-12-9-7-8-11-20(3,4)19-21-23-24-22-19/h13-14H,5-12H2,1-4H3,(H-,21,22,23,24,25)/q-1
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Article
5.5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity of the compound against human neutrophil Receptor.


Bioorg Med Chem Lett 5: 1995-2000 (1995)


Article DOI: 10.1016/0960-894X(95)00340-Y
BindingDB Entry DOI: 10.7270/Q2JW8DVR
More data for this
Ligand-Target Pair
Leukotriene B4 receptor


(Homo sapiens (Human))
BDBM50036743
PNG
(CHEMBL60617 | Sodium salt of 4-Ethyl-5-[6-methyl-6...)
Show SMILES CCCc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O
Show InChI InChI=1S/C20H31N4O2/c1-5-10-16-13-15(6-2)18(14-17(16)25)26-12-9-7-8-11-20(3,4)19-21-23-24-22-19/h13-14H,5-12H2,1-4H3,(H-,21,22,23,24,25)/q-1
PDB

UniProtKB/SwissProt

antibodypedia
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PC sid
UniChem

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Article
14n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against Guinea pig membrane LTB4 Receptor.


Bioorg Med Chem Lett 5: 1995-2000 (1995)


Article DOI: 10.1016/0960-894X(95)00340-Y
BindingDB Entry DOI: 10.7270/Q2JW8DVR
More data for this
Ligand-Target Pair
Leukotriene B4 receptor


(Homo sapiens (Human))
BDBM50036743
PNG
(CHEMBL60617 | Sodium salt of 4-Ethyl-5-[6-methyl-6...)
Show SMILES CCCc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O
Show InChI InChI=1S/C20H31N4O2/c1-5-10-16-13-15(6-2)18(14-17(16)25)26-12-9-7-8-11-20(3,4)19-21-23-24-22-19/h13-14H,5-12H2,1-4H3,(H-,21,22,23,24,25)/q-1
PDB

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Article
PubMed
14n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of [3H]LTB4 receptor binding in guinea pig lung membrane


J Med Chem 36: 3978-81 (1993)


Article DOI: 10.1021/jm00076a029
BindingDB Entry DOI: 10.7270/Q20V8G1H
More data for this
Ligand-Target Pair
Leukotriene B4 receptor


(Homo sapiens (Human))
BDBM50036743
PNG
(CHEMBL60617 | Sodium salt of 4-Ethyl-5-[6-methyl-6...)
Show SMILES CCCc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O
Show InChI InChI=1S/C20H31N4O2/c1-5-10-16-13-15(6-2)18(14-17(16)25)26-12-9-7-8-11-20(3,4)19-21-23-24-22-19/h13-14H,5-12H2,1-4H3,(H-,21,22,23,24,25)/q-1
PDB

UniProtKB/SwissProt

antibodypedia
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Article
PubMed
n/an/a 9.30n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of [3H]LTB4 receptor binding in human neutrophils


J Med Chem 36: 3978-81 (1993)


Article DOI: 10.1021/jm00076a029
BindingDB Entry DOI: 10.7270/Q20V8G1H
More data for this
Ligand-Target Pair
Leukotriene B4 receptor


(Homo sapiens (Human))
BDBM50036743
PNG
(CHEMBL60617 | Sodium salt of 4-Ethyl-5-[6-methyl-6...)
Show SMILES CCCc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O
Show InChI InChI=1S/C20H31N4O2/c1-5-10-16-13-15(6-2)18(14-17(16)25)26-12-9-7-8-11-20(3,4)19-21-23-24-22-19/h13-14H,5-12H2,1-4H3,(H-,21,22,23,24,25)/q-1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 161n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of LTB4-induced human neutrophil CD11b/CD18 integrin up-regulation


J Med Chem 36: 3978-81 (1993)


Article DOI: 10.1021/jm00076a029
BindingDB Entry DOI: 10.7270/Q20V8G1H
More data for this
Ligand-Target Pair
Leukotriene B4 receptor


(Homo sapiens (Human))
BDBM50036743
PNG
(CHEMBL60617 | Sodium salt of 4-Ethyl-5-[6-methyl-6...)
Show SMILES CCCc1cc(CC)c(OCCCCCC(C)(C)c2nn[n-]n2)cc1O
Show InChI InChI=1S/C20H31N4O2/c1-5-10-16-13-15(6-2)18(14-17(16)25)26-12-9-7-8-11-20(3,4)19-21-23-24-22-19/h13-14H,5-12H2,1-4H3,(H-,21,22,23,24,25)/q-1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 161n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against Guinea pig membrane LTB4 Receptor.


Bioorg Med Chem Lett 5: 1995-2000 (1995)


Article DOI: 10.1016/0960-894X(95)00340-Y
BindingDB Entry DOI: 10.7270/Q2JW8DVR
More data for this
Ligand-Target Pair