BDBM50348139 CHEMBL1800729

SMILES: CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N[C@H](C)COC(=O)[C@H](Cc1ccc(cc1)C(=O)c1ccccc1)NC(=O)CCCC#C

InChI Key: InChIKey=UXURBARGIFREAQ-XHSRFYJISA-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 = 50348139   

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))	BDBM50348139 (CHEMBL1800729) Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N[C@H](C)COC(=O)[C@H](Cc1ccc(cc1)C(=O)c1ccccc1)NC(=O)CCCC#C |r| Show InChI InChI=1S/C45H58N2O5/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-30-42(48)46-37(3)36-52-45(51)41(47-43(49)29-23-7-5-2)35-38-31-33-40(34-32-38)44(50)39-27-24-22-25-28-39/h2,10-11,13-14,16-17,19-20,22,24-25,27-28,31-34,37,41H,4,6-9,12,15,18,21,23,26,29-30,35-36H2,1,3H3,(H,46,48)(H,47,49)/b11-10-,14-13-,17-16-,20-19-/t37-,41+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Complutense de Madrid Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK-293-EBNA cell membranes after 90 mins by scintillation counting				J Med Chem 54: 5265-9 (2011) Article DOI: 10.1021/jm2004392 BindingDB Entry DOI: 10.7270/Q25D8S6J
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50348139 (CHEMBL1800729) Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N[C@H](C)COC(=O)[C@H](Cc1ccc(cc1)C(=O)c1ccccc1)NC(=O)CCCC#C |r| Show InChI InChI=1S/C45H58N2O5/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-30-42(48)46-37(3)36-52-45(51)41(47-43(49)29-23-7-5-2)35-38-31-33-40(34-32-38)44(50)39-27-24-22-25-28-39/h2,10-11,13-14,16-17,19-20,22,24-25,27-28,31-34,37,41H,4,6-9,12,15,18,21,23,26,29-30,35-36H2,1,3H3,(H,46,48)(H,47,49)/b11-10-,14-13-,17-16-,20-19-/t37-,41+/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Complutense de Madrid Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK-293-EBNA cell membranes after 90 mins by scintillation counting				J Med Chem 54: 5265-9 (2011) Article DOI: 10.1021/jm2004392 BindingDB Entry DOI: 10.7270/Q25D8S6J
					More data for this Ligand-Target Pair