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BDBM50116850 7-Methoxy-2-methyl-1-(2-morpholin-4-yl-ethyl)-1H-indole-3-carboxylic acid ((S)-1-isoxazol-3-yl-2-phenyl-ethyl)-amide::CHEMBL419289

SMILES: COc1cccc2c(C(=O)N[C@@H](Cc3ccccc3)c3ccon3)c(C)n(CCN3CCOCC3)c12

InChI Key: InChIKey=QPAOLJBNJZWLNB-DEOSSOPVSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50116850   
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))
BDBM50116850
PNG
(7-Methoxy-2-methyl-1-(2-morpholin-4-yl-ethyl)-1H-i...)
Show SMILES COc1cccc2c(C(=O)N[C@@H](Cc3ccccc3)c3ccon3)c(C)n(CCN3CCOCC3)c12
Show InChI InChI=1S/C28H32N4O4/c1-20-26(28(33)29-24(23-11-16-36-30-23)19-21-7-4-3-5-8-21)22-9-6-10-25(34-2)27(22)32(20)13-12-31-14-17-35-18-15-31/h3-11,16,24H,12-15,17-19H2,1-2H3,(H,29,33)/t24-/m0/s1
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Similars

PubMed
235n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Binding affinity against human CB2 receptor expressed in CHO cells by using WIN55,2122 Mesylate [5,73H] as Radioactive tracer


Bioorg Med Chem Lett 12: 2399-402 (2002)


BindingDB Entry DOI: 10.7270/Q2TM79FG
More data for this
Ligand-Target Pair