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BDBM50302386 1-[7-(3-Isopropyl-phenylamino)-3-methyl-1H-pyrrolo[2,3-c]pyridin-4-yl]-1-morpholin-4-yl-methanone::CHEMBL567302

SMILES: CC(C)Oc1ccccc1Nc1ncc(C(=O)N2CCOCC2)c2c(C)c[nH]c12

InChI Key: InChIKey=HEGRYZZKOBXYNP-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50302386   
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))
BDBM50302386
PNG
(1-[7-(3-Isopropyl-phenylamino)-3-methyl-1H-pyrrolo...)
Show SMILES CC(C)Oc1ccccc1Nc1ncc(C(=O)N2CCOCC2)c2c(C)c[nH]c12
Show InChI InChI=1S/C22H26N4O3/c1-14(2)29-18-7-5-4-6-17(18)25-21-20-19(15(3)12-23-20)16(13-24-21)22(27)26-8-10-28-11-9-26/h4-7,12-14,23H,8-11H2,1-3H3,(H,24,25)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 188n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant cannabinoid CB2 receptor expressed in MMY23 Saccharomyces cerevisiae assessed as degradation of FDGlu to fluore...


J Med Chem 52: 5785-8 (2009)


Article DOI: 10.1021/jm9009857
BindingDB Entry DOI: 10.7270/Q20R9PG5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50302386
PNG
(1-[7-(3-Isopropyl-phenylamino)-3-methyl-1H-pyrrolo...)
Show SMILES CC(C)Oc1ccccc1Nc1ncc(C(=O)N2CCOCC2)c2c(C)c[nH]c12
Show InChI InChI=1S/C22H26N4O3/c1-14(2)29-18-7-5-4-6-17(18)25-21-20-19(15(3)12-23-20)16(13-24-21)22(27)26-8-10-28-11-9-26/h4-7,12-14,23H,8-11H2,1-3H3,(H,24,25)
PDB

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Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant cannabinoid CB1 receptor expressed in MMY23 Saccharomyces cerevisiae assessed as degradation of FDGlu to fluore...


J Med Chem 52: 5785-8 (2009)


Article DOI: 10.1021/jm9009857
BindingDB Entry DOI: 10.7270/Q20R9PG5
More data for this
Ligand-Target Pair