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BDBM50302378 1-[7-(3-Chloro-phenylamino)-3-methyl-1H-pyrrolo[2,3-c]pyridin-4-yl]-1-piperidin-1-yl-methanone::CHEMBL585580

SMILES: Cc1c[nH]c2c(Nc3cccc(Cl)c3)ncc(C(=O)N3CCCCC3)c12

InChI Key: InChIKey=UAZJIHKIKOFYKU-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 = 50302378   
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))
BDBM50302378
PNG
(1-[7-(3-Chloro-phenylamino)-3-methyl-1H-pyrrolo[2,...)
Show SMILES Cc1c[nH]c2c(Nc3cccc(Cl)c3)ncc(C(=O)N3CCCCC3)c12
Show InChI InChI=1S/C20H21ClN4O/c1-13-11-22-18-17(13)16(20(26)25-8-3-2-4-9-25)12-23-19(18)24-15-7-5-6-14(21)10-15/h5-7,10-12,22H,2-4,8-9H2,1H3,(H,23,24)
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Similars

Article
PubMed
n/an/an/an/a 14n/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))
BDBM50302378
PNG
(1-[7-(3-Chloro-phenylamino)-3-methyl-1H-pyrrolo[2,...)
Show SMILES Cc1c[nH]c2c(Nc3cccc(Cl)c3)ncc(C(=O)N3CCCCC3)c12
Show InChI InChI=1S/C20H21ClN4O/c1-13-11-22-18-17(13)16(20(26)25-8-3-2-4-9-25)12-23-19(18)24-15-7-5-6-14(21)10-15/h5-7,10-12,22H,2-4,8-9H2,1H3,(H,23,24)
PDB

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Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 4.00E+3n/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