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BDBM50107602 (5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid furan-2-ylmethyl ester::CHEMBL38293::Icosa-5,8,11,14-tetraenoic acid furan-2-ylmethyl ester

SMILES: CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCc1ccco1

InChI Key: InChIKey=GSAYXEIDCUNWNR-DOFZRALJSA-N

Data: 6 KI  1 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 = 50107602   
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
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50107602
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid fu...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCc1ccco1
Show InChI InChI=1S/C25H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(26)28-23-24-20-19-22-27-24/h6-7,9-10,12-13,15-16,19-20,22H,2-5,8,11,14,17-18,21,23H2,1H3/b7-6-,10-9-,13-12-,16-15-
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>1.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity to CB1 cannabinoid receptor using [3H]WIN-55212-2 in rat cerebellum membranes


J Med Chem 44: 4505-8 (2001)


BindingDB Entry DOI: 10.7270/Q29G5NJ5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50107602
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid fu...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCc1ccco1
Show InChI InChI=1S/C25H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(26)28-23-24-20-19-22-27-24/h6-7,9-10,12-13,15-16,19-20,22H,2-5,8,11,14,17-18,21,23H2,1H3/b7-6-,10-9-,13-12-,16-15-
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>1.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity to human CB2 cannabinoid receptor using [3H]CP-55940 in HEK293 EBNA transfected cells


J Med Chem 44: 4505-8 (2001)


BindingDB Entry DOI: 10.7270/Q29G5NJ5
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50107602
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid fu...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCc1ccco1
Show InChI InChI=1S/C25H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(26)28-23-24-20-19-22-27-24/h6-7,9-10,12-13,15-16,19-20,22H,2-5,8,11,14,17-18,21,23H2,1H3/b7-6-,10-9-,13-12-,16-15-
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>5.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity against vanilloid receptor 1 (VR1) using [3H]RTX in rat spinal cord membranes


J Med Chem 46: 1512-22 (2003)


Article DOI: 10.1021/jm0210818
BindingDB Entry DOI: 10.7270/Q2GQ6ZHS
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50107602
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid fu...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCc1ccco1
Show InChI InChI=1S/C25H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(26)28-23-24-20-19-22-27-24/h6-7,9-10,12-13,15-16,19-20,22H,2-5,8,11,14,17-18,21,23H2,1H3/b7-6-,10-9-,13-12-,16-15-
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>5.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity to vanilloid VR1 receptor using [3H]resiniferatoxin ([3H]-RTX) in rat spinal cord membranes


J Med Chem 44: 4505-8 (2001)


BindingDB Entry DOI: 10.7270/Q29G5NJ5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50107602
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid fu...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCc1ccco1
Show InChI InChI=1S/C25H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(26)28-23-24-20-19-22-27-24/h6-7,9-10,12-13,15-16,19-20,22H,2-5,8,11,14,17-18,21,23H2,1H3/b7-6-,10-9-,13-12-,16-15-
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PubMed
>5.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity against G protein coupled human Cannabinoid receptor 2 using [3H]CP-55940 in HEK293 EBNA transfected cells


J Med Chem 46: 1512-22 (2003)


Article DOI: 10.1021/jm0210818
BindingDB Entry DOI: 10.7270/Q2GQ6ZHS
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50107602
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid fu...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCc1ccco1
Show InChI InChI=1S/C25H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(26)28-23-24-20-19-22-27-24/h6-7,9-10,12-13,15-16,19-20,22H,2-5,8,11,14,17-18,21,23H2,1H3/b7-6-,10-9-,13-12-,16-15-
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>5.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity against G protein coupled Cannabinoid receptor 1 using [3H]WIN-55212-2 in rat cerebellum membranes


J Med Chem 46: 1512-22 (2003)


Article DOI: 10.1021/jm0210818
BindingDB Entry DOI: 10.7270/Q2GQ6ZHS
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 (aa 30-579)


(Rattus norvegicus (rat))
BDBM50107602
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid fu...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OCc1ccco1
Show InChI InChI=1S/C25H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(26)28-23-24-20-19-22-27-24/h6-7,9-10,12-13,15-16,19-20,22H,2-5,8,11,14,17-18,21,23H2,1H3/b7-6-,10-9-,13-12-,16-15-
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n/an/a 5.30E+4n/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Inhibition of fatty acid amide hydrolase (FAAH) was determined using rat brain homogenates as the enzyme source and [3H]anandamide as substrate


J Med Chem 46: 1512-22 (2003)


Article DOI: 10.1021/jm0210818
BindingDB Entry DOI: 10.7270/Q2GQ6ZHS
More data for this
Ligand-Target Pair