BDBM50541730 CHEMBL4641784

SMILES: CCCn1c2cn(CCO)nc2c(O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)c1=O

InChI Key: InChIKey=BUBWMFHFNVBWBM-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 = 50541730   

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))	BDBM50541730 (CHEMBL4641784) Show SMILES CCCn1c2cn(CCO)nc2c(O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)c1=O |TLB:21:22:20.19.25:26,THB:21:20:27.22.23:26,23:22:19:25.24.26,23:24:27.22.21:19| Show InChI InChI=1S/C22H30N4O4/c1-2-3-26-16-12-25(4-5-27)24-18(16)19(28)17(21(26)30)20(29)23-22-9-13-6-14(10-22)8-15(7-13)11-22/h12-15,27-28H,2-11H2,1H3,(H,23,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	159	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))	BDBM50541730 (CHEMBL4641784) Show SMILES CCCn1c2cn(CCO)nc2c(O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)c1=O |TLB:21:22:20.19.25:26,THB:21:20:27.22.23:26,23:22:19:25.24.26,23:24:27.22.21:19| Show InChI InChI=1S/C22H30N4O4/c1-2-3-26-16-12-25(4-5-27)24-18(16)19(28)17(21(26)30)20(29)23-22-9-13-6-14(10-22)8-15(7-13)11-22/h12-15,27-28H,2-11H2,1H3,(H,23,29)	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