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SMILES: COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2cc(F)cc(F)c2)cc1

InChI Key: InChIKey=PSWUOSREFSNAIT-UHFFFAOYSA-N

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 4 hits for monomerid = 50516295   
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 2


(Homo sapiens (Human))
BDBM50516295
PNG
(CHEMBL4473103)
Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2cc(F)cc(F)c2)cc1
Show InChI InChI=1S/C29H21F2NO3/c1-34-24-12-8-20(9-13-24)29-27(25-4-2-3-5-26(25)35-29)28(33)19-6-10-23(11-7-19)32-17-18-14-21(30)16-22(31)15-18/h2-16,32H,17H2,1H3
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300n/an/an/an/an/an/an/an/a



Alma Mater Studiorum-University of Bologna

Curated by ChEMBL


Assay Description
Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...


Eur J Med Chem 178: 243-258 (2019)


Article DOI: 10.1016/j.ejmech.2019.05.080
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50516295
PNG
(CHEMBL4473103)
Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2cc(F)cc(F)c2)cc1
Show InChI InChI=1S/C29H21F2NO3/c1-34-24-12-8-20(9-13-24)29-27(25-4-2-3-5-26(25)35-29)28(33)19-6-10-23(11-7-19)32-17-18-14-21(30)16-22(31)15-18/h2-16,32H,17H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Alma Mater Studiorum-University of Bologna

Curated by ChEMBL


Assay Description
Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...


Eur J Med Chem 178: 243-258 (2019)


Article DOI: 10.1016/j.ejmech.2019.05.080
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50516295
PNG
(CHEMBL4473103)
Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2cc(F)cc(F)c2)cc1
Show InChI InChI=1S/C29H21F2NO3/c1-34-24-12-8-20(9-13-24)29-27(25-4-2-3-5-26(25)35-29)28(33)19-6-10-23(11-7-19)32-17-18-14-21(30)16-22(31)15-18/h2-16,32H,17H2,1H3
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n/an/a 1.15E+3n/an/an/an/an/an/a



Alma Mater Studiorum-University of Bologna

Curated by ChEMBL


Assay Description
Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins


Eur J Med Chem 178: 243-258 (2019)


Article DOI: 10.1016/j.ejmech.2019.05.080
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50516295
PNG
(CHEMBL4473103)
Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2cc(F)cc(F)c2)cc1
Show InChI InChI=1S/C29H21F2NO3/c1-34-24-12-8-20(9-13-24)29-27(25-4-2-3-5-26(25)35-29)28(33)19-6-10-23(11-7-19)32-17-18-14-21(30)16-22(31)15-18/h2-16,32H,17H2,1H3
PDB

NCI pathway
Reactome pathway
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antibodypedia
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PC cid
PC sid
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Alma Mater Studiorum-University of Bologna

Curated by ChEMBL


Assay Description
Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins


Eur J Med Chem 178: 243-258 (2019)


Article DOI: 10.1016/j.ejmech.2019.05.080
More data for this
Ligand-Target Pair