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BDBM50272085 CHEMBL499332::N-(9-Ethyl-9H-carbazol-3-yl)-3-(5-(2-fluorophenyl)-2H-tetrazol-2-yl)propanamide

SMILES: CCn1c2ccccc2c2cc(NC(=O)CCn3nnc(n3)-c3ccccc3F)ccc12

InChI Key: InChIKey=HMRUGQIFAQWKBQ-UHFFFAOYSA-N

Data: 6 EC50

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 = 50272085   
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))
BDBM50272085
PNG
(CHEMBL499332 | N-(9-Ethyl-9H-carbazol-3-yl)-3-(5-(...)
Show SMILES CCn1c2ccccc2c2cc(NC(=O)CCn3nnc(n3)-c3ccccc3F)ccc12
Show InChI InChI=1S/C24H21FN6O/c1-2-30-21-10-6-4-7-17(21)19-15-16(11-12-22(19)30)26-23(32)13-14-31-28-24(27-29-31)18-8-3-5-9-20(18)25/h3-12,15H,2,13-14H2,1H3,(H,26,32)
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n/an/an/an/a>1.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at rat recombinant CB1 receptor expressed in CHO-K1 cells assessed as inhibition of forskolin-stimulated intracellular cAMP level


J Med Chem 51: 5019-34 (2008)


Article DOI: 10.1021/jm800463f
BindingDB Entry DOI: 10.7270/Q2W096VS
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50272085
PNG
(CHEMBL499332 | N-(9-Ethyl-9H-carbazol-3-yl)-3-(5-(...)
Show SMILES CCn1c2ccccc2c2cc(NC(=O)CCn3nnc(n3)-c3ccccc3F)ccc12
Show InChI InChI=1S/C24H21FN6O/c1-2-30-21-10-6-4-7-17(21)19-15-16(11-12-22(19)30)26-23(32)13-14-31-28-24(27-29-31)18-8-3-5-9-20(18)25/h3-12,15H,2,13-14H2,1H3,(H,26,32)
KEGG

UniProtKB/SwissProt

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PC sid
UniChem
Article
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n/an/an/an/a 97n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at rat recombinant CB2 receptor expressed in CHO-K1 cells assessed as inhibition of forskolin-stimulated intracellular cAMP level


J Med Chem 51: 5019-34 (2008)


Article DOI: 10.1021/jm800463f
BindingDB Entry DOI: 10.7270/Q2W096VS
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50272085
PNG
(CHEMBL499332 | N-(9-Ethyl-9H-carbazol-3-yl)-3-(5-(...)
Show SMILES CCn1c2ccccc2c2cc(NC(=O)CCn3nnc(n3)-c3ccccc3F)ccc12
Show InChI InChI=1S/C24H21FN6O/c1-2-30-21-10-6-4-7-17(21)19-15-16(11-12-22(19)30)26-23(32)13-14-31-28-24(27-29-31)18-8-3-5-9-20(18)25/h3-12,15H,2,13-14H2,1H3,(H,26,32)
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n/an/an/an/a 200n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in Sf9 cells by GTP-europium binding assay


J Med Chem 51: 5019-34 (2008)


Article DOI: 10.1021/jm800463f
BindingDB Entry DOI: 10.7270/Q2W096VS
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50272085
PNG
(CHEMBL499332 | N-(9-Ethyl-9H-carbazol-3-yl)-3-(5-(...)
Show SMILES CCn1c2ccccc2c2cc(NC(=O)CCn3nnc(n3)-c3ccccc3F)ccc12
Show InChI InChI=1S/C24H21FN6O/c1-2-30-21-10-6-4-7-17(21)19-15-16(11-12-22(19)30)26-23(32)13-14-31-28-24(27-29-31)18-8-3-5-9-20(18)25/h3-12,15H,2,13-14H2,1H3,(H,26,32)
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n/an/an/an/a 690n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO-K1 cells assessed as inhibition of forskolin-stimulated intracellular cAMP level


J Med Chem 51: 5019-34 (2008)


Article DOI: 10.1021/jm800463f
BindingDB Entry DOI: 10.7270/Q2W096VS
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50272085
PNG
(CHEMBL499332 | N-(9-Ethyl-9H-carbazol-3-yl)-3-(5-(...)
Show SMILES CCn1c2ccccc2c2cc(NC(=O)CCn3nnc(n3)-c3ccccc3F)ccc12
Show InChI InChI=1S/C24H21FN6O/c1-2-30-21-10-6-4-7-17(21)19-15-16(11-12-22(19)30)26-23(32)13-14-31-28-24(27-29-31)18-8-3-5-9-20(18)25/h3-12,15H,2,13-14H2,1H3,(H,26,32)
PDB

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n/an/an/an/a>1.00E+4n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor expressed in Sf9 cells by GTP-europium binding assay


J Med Chem 51: 5019-34 (2008)


Article DOI: 10.1021/jm800463f
BindingDB Entry DOI: 10.7270/Q2W096VS
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50272085
PNG
(CHEMBL499332 | N-(9-Ethyl-9H-carbazol-3-yl)-3-(5-(...)
Show SMILES CCn1c2ccccc2c2cc(NC(=O)CCn3nnc(n3)-c3ccccc3F)ccc12
Show InChI InChI=1S/C24H21FN6O/c1-2-30-21-10-6-4-7-17(21)19-15-16(11-12-22(19)30)26-23(32)13-14-31-28-24(27-29-31)18-8-3-5-9-20(18)25/h3-12,15H,2,13-14H2,1H3,(H,26,32)
PDB

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PC cid
PC sid
UniChem
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PubMed
n/an/an/an/a>1.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB1 receptor expressed in CHO-K1 cells assessed as inhibition of forskolin-stimulated intracellular cAMP level


J Med Chem 51: 5019-34 (2008)


Article DOI: 10.1021/jm800463f
BindingDB Entry DOI: 10.7270/Q2W096VS
More data for this
Ligand-Target Pair