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BDBM50092582 CHEMBL127919::[3-(1,1-Dimethyl-butyl)-6,6-dimethyl-6H-benzo[c]chromen-9-yl]-methanol

SMILES: CCCC(C)(C)c1ccc-2c(OC(C)(C)c3ccc(CO)cc-23)c1

InChI Key: InChIKey=WOUGNVGXCUXHJS-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50092582   
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))
BDBM50092582
PNG
(CHEMBL127919 | [3-(1,1-Dimethyl-butyl)-6,6-dimethy...)
Show SMILES CCCC(C)(C)c1ccc-2c(OC(C)(C)c3ccc(CO)cc-23)c1
Show InChI InChI=1S/C22H28O2/c1-6-11-21(2,3)16-8-9-17-18-12-15(14-23)7-10-19(18)22(4,5)24-20(17)13-16/h7-10,12-13,23H,6,11,14H2,1-5H3
PDB

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PC cid
PC sid
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Similars

PubMed
67n/an/an/an/an/an/an/an/a



Organix, Inc.

Curated by ChEMBL


Assay Description
Binding affinity was determined for Cannabinoid receptor 2


J Med Chem 43: 3778-85 (2000)


BindingDB Entry DOI: 10.7270/Q27M0754
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50092582
PNG
(CHEMBL127919 | [3-(1,1-Dimethyl-butyl)-6,6-dimethy...)
Show SMILES CCCC(C)(C)c1ccc-2c(OC(C)(C)c3ccc(CO)cc-23)c1
Show InChI InChI=1S/C22H28O2/c1-6-11-21(2,3)16-8-9-17-18-12-15(14-23)7-10-19(18)22(4,5)24-20(17)13-16/h7-10,12-13,23H,6,11,14H2,1-5H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
204n/an/an/an/an/an/an/an/a



Organix, Inc.

Curated by ChEMBL


Assay Description
Binding affinity was determined for Cannabinoid receptor 1


J Med Chem 43: 3778-85 (2000)


BindingDB Entry DOI: 10.7270/Q27M0754
More data for this
Ligand-Target Pair