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BDBM50193283 CHEMBL3924830

SMILES: Cc1ccc(Cn2nc(C(=O)NCC3CCC4CC3C4(C)C)c3CCCc4ccc(Cl)cc4-c23)cc1

InChI Key: InChIKey=FEFKKCCDYVFDDA-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 = 50193283   
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))
BDBM50193283
PNG
(CHEMBL3924830)
Show SMILES Cc1ccc(Cn2nc(C(=O)NCC3CCC4CC3C4(C)C)c3CCCc4ccc(Cl)cc4-c23)cc1
Show InChI InChI=1S/C31H36ClN3O/c1-19-7-9-20(10-8-19)18-35-29-25(6-4-5-21-12-14-24(32)16-26(21)29)28(34-35)30(36)33-17-22-11-13-23-15-27(22)31(23,2)3/h7-10,12,14,16,22-23,27H,4-6,11,13,15,17-18H2,1-3H3,(H,33,36)
PDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
51n/an/an/an/an/an/an/an/a



Neuroscienze PharmaNess S.c.a r.l.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor transfected in CHO cell membranes after 60 mins by liquid scintillation spectrometry


Eur J Med Chem 121: 194-208 (2016)


Article DOI: 10.1016/j.ejmech.2016.05.011
BindingDB Entry DOI: 10.7270/Q2PR7XXB
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50193283
PNG
(CHEMBL3924830)
Show SMILES Cc1ccc(Cn2nc(C(=O)NCC3CCC4CC3C4(C)C)c3CCCc4ccc(Cl)cc4-c23)cc1
Show InChI InChI=1S/C31H36ClN3O/c1-19-7-9-20(10-8-19)18-35-29-25(6-4-5-21-12-14-24(32)16-26(21)29)28(34-35)30(36)33-17-22-11-13-23-15-27(22)31(23,2)3/h7-10,12,14,16,22-23,27H,4-6,11,13,15,17-18H2,1-3H3,(H,33,36)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
169n/an/an/an/an/an/an/an/a



Neuroscienze PharmaNess S.c.a r.l.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from CB1 receptor in mouse whole brain membranes after 60 mins by liquid scintillation spectrometry


Eur J Med Chem 121: 194-208 (2016)


Article DOI: 10.1016/j.ejmech.2016.05.011
BindingDB Entry DOI: 10.7270/Q2PR7XXB
More data for this
Ligand-Target Pair