BDBM50212599 CHEMBL426912::N-Isobutyl-(2E,4E)-dodecadienamide::N-Isobutyl-(2E,4E-dodeca-2,4-dienamide::dodeca-2E,4E-dienoic acid isobutylamide

SMILES: CCCCCCC\C=C\C=C\C(=O)NCC(C)C

InChI Key: InChIKey=BBRMJCAPNGJKEM-AQASXUMVSA-N

Data: 7 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 7 hits for monomerid = 50212599   

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
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50212599 (CHEMBL426912 | N-Isobutyl-(2E,4E)-dodecadienamide ...) Show SMILES CCCCCCC\C=C\C=C\C(=O)NCC(C)C Show InChI InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Department of Chemistry and Applied Biosciences Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in HEK cells				J Nat Prod 70: 1010-5 (2007) Article DOI: 10.1021/np060598+ BindingDB Entry DOI: 10.7270/Q2930SV5
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50212599 (CHEMBL426912 | N-Isobutyl-(2E,4E)-dodecadienamide ...) Show SMILES CCCCCCC\C=C\C=C\C(=O)NCC(C)C Show InChI InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Concordia University Wisconsin Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from recombinant human CB2 receptor expressed in HEK293 cell membranes after 90 mins by scintillation counting method				J Nat Prod 82: 636-646 (2019) Article DOI: 10.1021/acs.jnatprod.8b00874
					More data for this Ligand-Target Pair
Cannabinoid receptor (MOUSE)	BDBM50212599 (CHEMBL426912 | N-Isobutyl-(2E,4E)-dodecadienamide ...) Show SMILES CCCCCCC\C=C\C=C\C(=O)NCC(C)C Show InChI InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UOS of Cagliari Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55940 from cannabinoid CB2 receptor in CD1 mouse spleen membranes after 1 hr by liquid scintillation counting				Bioorg Med Chem 21: 7074-82 (2013) Article DOI: 10.1016/j.bmc.2013.09.017 BindingDB Entry DOI: 10.7270/Q25D8VTF
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50212599 (CHEMBL426912 | N-Isobutyl-(2E,4E)-dodecadienamide ...) Show SMILES CCCCCCC\C=C\C=C\C(=O)NCC(C)C Show InChI InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.94E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Concordia University Wisconsin Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from recombinant human CB1 receptor expressed in HEK293-EBNA cell membranes after 90 mins by scintillation counting meth...				J Nat Prod 82: 636-646 (2019) Article DOI: 10.1021/acs.jnatprod.8b00874
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Mus musculus (Mouse))	BDBM50212599 (CHEMBL426912 | N-Isobutyl-(2E,4E)-dodecadienamide ...) Show SMILES CCCCCCC\C=C\C=C\C(=O)NCC(C)C Show InChI InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UOS of Cagliari Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55940 from cannabinoid CB1 receptor in CD1 mouse brain membranes after 1 hr by liquid scintillation counting				Bioorg Med Chem 21: 7074-82 (2013) Article DOI: 10.1016/j.bmc.2013.09.017 BindingDB Entry DOI: 10.7270/Q25D8VTF
					More data for this Ligand-Target Pair
Opioid receptors; mu and delta (MOUSE)	BDBM50212599 (CHEMBL426912 | N-Isobutyl-(2E,4E)-dodecadienamide ...) Show SMILES CCCCCCC\C=C\C=C\C(=O)NCC(C)C Show InChI InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	8.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UOS of Cagliari Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in CD1 mouse brain membranes after 1 hr by liquid scintillation counting				Bioorg Med Chem 21: 7074-82 (2013) Article DOI: 10.1016/j.bmc.2013.09.017 BindingDB Entry DOI: 10.7270/Q25D8VTF
					More data for this Ligand-Target Pair
Opioid receptors; mu and delta (MOUSE)	BDBM50212599 (CHEMBL426912 | N-Isobutyl-(2E,4E)-dodecadienamide ...) Show SMILES CCCCCCC\C=C\C=C\C(=O)NCC(C)C Show InChI InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	4.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UOS of Cagliari Curated by ChEMBL					Assay Description Displacement of [3H]DPDPE from delta opioid receptor in CD1 mouse brain membranes after 1 hr by liquid scintillation counting				Bioorg Med Chem 21: 7074-82 (2013) Article DOI: 10.1016/j.bmc.2013.09.017 BindingDB Entry DOI: 10.7270/Q25D8VTF
					More data for this Ligand-Target Pair