BDBM50541731 CHEMBL4643391

SMILES: CCCCn1c2cn(CCO)nc2c(O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)c1=O

InChI Key: InChIKey=PHTQOYPUVDVNES-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 = 50541731   

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))	BDBM50541731 (CHEMBL4643391) Show SMILES CCCCn1c2cn(CCO)nc2c(O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)c1=O |TLB:22:23:21.20.26:27,THB:22:21:28.23.24:27,24:23:20:26.25.27,24:25:28.23.22:20| Show InChI InChI=1S/C23H32N4O4/c1-2-3-4-27-17-13-26(5-6-28)25-19(17)20(29)18(22(27)31)21(30)24-23-10-14-7-15(11-23)9-16(8-14)12-23/h13-16,28-29H,2-12H2,1H3,(H,24,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55,940 from recombinant human CB2R expressed in HEK293 cell membranes				J Med Chem 63: 7369-7391 (2020)
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50541731 (CHEMBL4643391) Show SMILES CCCCn1c2cn(CCO)nc2c(O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)c1=O |TLB:22:23:21.20.26:27,THB:22:21:28.23.24:27,24:23:20:26.25.27,24:25:28.23.22:20| Show InChI InChI=1S/C23H32N4O4/c1-2-3-4-27-17-13-26(5-6-28)25-19(17)20(29)18(22(27)31)21(30)24-23-10-14-7-15(11-23)9-16(8-14)12-23/h13-16,28-29H,2-12H2,1H3,(H,24,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55,940 from recombinant human CB1R expressed in HEK293 cell membranes				J Med Chem 63: 7369-7391 (2020)
					More data for this Ligand-Target Pair