BDBM50121429 2-(6-Isopropenyl-3-methyl-cyclohex-2-enyl)-5-pentyl-benzene-1,3-diol::2-(6-Isopropenyl-3-methyl-cyclohex-2-enyl)-5-pentyl-benzene-1,3-diol (Cannabidiol)::CANNABIDIOL::CBD::Cannabidiol

SMILES: [H][C@]1(C=C(C)CC[C@H]1C(C)=C)c1c(O)cc(CCCCC)cc1O

InChI Key: InChIKey=QHMBSVQNZZTUGM-ZWKOTPCHSA-N

Data: 3 KI

PDB links: 3 PDB IDs match this monomer.

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 3 hits for monomerid = 50121429   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Liver fatty acid binding protein (FABP1) (Mus musculus (Mouse))	BDBM50121429 (2-(6-Isopropenyl-3-methyl-cyclohex-2-enyl)-5-penty...) Show SMILES [H][C@]1(C=C(C)CC[C@H]1C(C)=C)c1c(O)cc(CCCCC)cc1O |r,t:2| Show InChI InChI=1S/C21H30O2/c1-5-6-7-8-16-12-19(22)21(20(23)13-16)18-11-15(4)9-10-17(18)14(2)3/h11-13,17-18,22-23H,2,5-10H2,1,3-4H3/t17-,18+/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	167	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Avanti Polar Lipids					Assay Description The following fluorescent ligand displacement assays at 24 °C were used to further confirm and/or determine if the cytosolic lipidic ligand "chaperon...				Biochemistry 55: 5243-55 (2016) Article DOI: 10.1021/acs.biochem.6b00446 BindingDB Entry DOI: 10.7270/Q2MS3RJJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (MOUSE)	BDBM50121429 (2-(6-Isopropenyl-3-methyl-cyclohex-2-enyl)-5-penty...) Show SMILES [H][C@]1(C=C(C)CC[C@H]1C(C)=C)c1c(O)cc(CCCCC)cc1O |r,t:2| Show InChI InChI=1S/C21H30O2/c1-5-6-7-8-16-12-19(22)21(20(23)13-16)18-11-15(4)9-10-17(18)14(2)3/h11-13,17-18,22-23H,2,5-10H2,1,3-4H3/t17-,18+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Hellenic Research Foundation Curated by ChEMBL					Assay Description Binding affinity for Cannabinoid receptor 2 by the ability to displace radiolabeled CP-55,940 from mouse spleen synaptosomes				Bioorg Med Chem Lett 12: 3583-6 (2002) BindingDB Entry DOI: 10.7270/Q2K936VT
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50121429 (2-(6-Isopropenyl-3-methyl-cyclohex-2-enyl)-5-penty...) Show SMILES [H][C@]1(C=C(C)CC[C@H]1C(C)=C)c1c(O)cc(CCCCC)cc1O |r,t:2| Show InChI InChI=1S/C21H30O2/c1-5-6-7-8-16-12-19(22)21(20(23)13-16)18-11-15(4)9-10-17(18)14(2)3/h11-13,17-18,22-23H,2,5-10H2,1,3-4H3/t17-,18+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	1.27E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Hellenic Research Foundation Curated by ChEMBL					Assay Description Binding affinity for Cannabinoid receptor 1 by the ability to displace radiolabeled CP-55,940 from purified rat forbrain synaptosomes				Bioorg Med Chem Lett 12: 3583-6 (2002) BindingDB Entry DOI: 10.7270/Q2K936VT
					More data for this Ligand-Target Pair