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BDBM50058506 CHEMBL3331458

SMILES: Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCCC1

InChI Key: InChIKey=PTPHXSBXJACUNJ-UHFFFAOYSA-N

Data: 2 KI

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 = 50058506   
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


(MOUSE)
BDBM50058506
PNG
(CHEMBL3331458)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCCC1
Show InChI InChI=1S/C22H22Cl2N4OS/c1-13-12-30-18-11-15-20(22(29)26-27-8-4-2-3-5-9-27)25-28(21(15)19(13)18)17-7-6-14(23)10-16(17)24/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,26,29)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
321n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058506
PNG
(CHEMBL3331458)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCCC1
Show InChI InChI=1S/C22H22Cl2N4OS/c1-13-12-30-18-11-15-20(22(29)26-27-8-4-2-3-5-9-27)25-28(21(15)19(13)18)17-7-6-14(23)10-16(17)24/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,26,29)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
3.80E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair