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BDBM50392307 CHEMBL2153668

SMILES: NC(=O)[C@H](Cc1ccccc1)N=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1

InChI Key: InChIKey=ROYLFSPKCIXLCA-CPRJBALCSA-N

Data: 1 IC50

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

Found 1 hit for monomerid = 50392307   
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))
BDBM50392307
PNG
(CHEMBL2153668)
Show SMILES NC(=O)[C@H](Cc1ccccc1)N=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |r,w:12.13,c:29|
Show InChI InChI=1S/C31H27Cl2N5O3S/c32-24-13-11-23(12-14-24)29-27(22-9-5-2-6-10-22)20-38(36-29)31(37-42(40,41)26-17-15-25(33)16-18-26)35-28(30(34)39)19-21-7-3-1-4-8-21/h1-18,27-28H,19-20H2,(H2,34,39)(H,35,37)/t27?,28-/m0/s1
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Similars

Article
PubMed
n/an/a>5.00E+3n/an/an/an/an/an/a



Jenrin Discovery

Curated by ChEMBL


Assay Description
Displacement of 3[H]ligand from recombinant human CB2 receptor


Bioorg Med Chem Lett 22: 6173-80 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.004
BindingDB Entry DOI: 10.7270/Q2BV7HR2
More data for this
Ligand-Target Pair