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BDBM50213159 4'-(1,1-dimethyl-heptyl)-2'-hydroxy-biphenyl-3-carboxylic acid::CHEMBL236624

SMILES: CCCCCCC(C)(C)c1ccc(c(O)c1)-c1cccc(c1)C(O)=O

InChI Key: InChIKey=BSCVBLAAUQIHKD-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 = 50213159   
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))
BDBM50213159
PNG
(4'-(1,1-dimethyl-heptyl)-2'-hydroxy-biphenyl-3-car...)
Show SMILES CCCCCCC(C)(C)c1ccc(c(O)c1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C22H28O3/c1-4-5-6-7-13-22(2,3)18-11-12-19(20(23)15-18)16-9-8-10-17(14-16)21(24)25/h8-12,14-15,23H,4-7,13H2,1-3H3,(H,24,25)
PDB

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from cloned human CB2 receptor


Bioorg Med Chem Lett 17: 3652-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.059
BindingDB Entry DOI: 10.7270/Q2GM8703
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50213159
PNG
(4'-(1,1-dimethyl-heptyl)-2'-hydroxy-biphenyl-3-car...)
Show SMILES CCCCCCC(C)(C)c1ccc(c(O)c1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C22H28O3/c1-4-5-6-7-13-22(2,3)18-11-12-19(20(23)15-18)16-9-8-10-17(14-16)21(24)25/h8-12,14-15,23H,4-7,13H2,1-3H3,(H,24,25)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from cloned human CB1 receptor


Bioorg Med Chem Lett 17: 3652-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.059
BindingDB Entry DOI: 10.7270/Q2GM8703
More data for this
Ligand-Target Pair