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BDBM50383394 CHEMBL2030746

SMILES: Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)Nc1ccc(F)cc1)c1ccccc1

InChI Key: InChIKey=LZCUWHSBVJZZNX-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50383394   
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 1


(Homo sapiens (Human))
BDBM50383394
PNG
(CHEMBL2030746)
Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)Nc1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C35H29Cl3FN5O2/c1-22-31(42-44(30-16-11-26(37)21-29(30)38)32(22)23-7-9-25(36)10-8-23)33(45)43-19-17-35(18-20-43,24-5-3-2-4-6-24)41-34(46)40-28-14-12-27(39)13-15-28/h2-16,21H,17-20H2,1H3,(H2,40,41,46)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
614n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells


J Med Chem 55: 2820-34 (2012)


Article DOI: 10.1021/jm201731z
BindingDB Entry DOI: 10.7270/Q2P2704Z
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50383394
PNG
(CHEMBL2030746)
Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)Nc1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C35H29Cl3FN5O2/c1-22-31(42-44(30-16-11-26(37)21-29(30)38)32(22)23-7-9-25(36)10-8-23)33(45)43-19-17-35(18-20-43,24-5-3-2-4-6-24)41-34(46)40-28-14-12-27(39)13-15-28/h2-16,21H,17-20H2,1H3,(H2,40,41,46)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.00E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells


J Med Chem 55: 2820-34 (2012)


Article DOI: 10.1021/jm201731z
BindingDB Entry DOI: 10.7270/Q2P2704Z
More data for this
Ligand-Target Pair