BDBM50156026 CHEMBL3781594

SMILES: COCCOCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2cc(ccc12)C(C)C

InChI Key: InChIKey=IGVNKCIJORHOQN-LNWTWIFDSA-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 = 50156026   

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))	BDBM50156026 (CHEMBL3781594) Show SMILES COCCOCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2cc(ccc12)C(C)C |TLB:19:18:21:15.14.13,19:14:21:18.20.17,THB:17:18:15.16.21:13,17:16:13:18.20.19| Show InChI InChI=1S/C31H37NO11S/c1-14(33)38-13-22-26(39-15(2)34)27(40-16(3)35)28(41-17(4)36)30(42-22)44-23-9-7-19-20-12-18-6-8-21(37)25-24(18)31(19,29(23)43-25)10-11-32(20)5/h6-9,19-20,22-23,26-30,37H,10-13H2,1-5H3/t19-,20+,22?,23?,26?,27?,28?,29-,30?,31-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	480	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells after 90 mins by Competition binding assay				J Med Chem 59: 1052-67 (2016) BindingDB Entry DOI: 10.7270/Q2GB25XB
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50156026 (CHEMBL3781594) Show SMILES COCCOCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2cc(ccc12)C(C)C |TLB:19:18:21:15.14.13,19:14:21:18.20.17,THB:17:18:15.16.21:13,17:16:13:18.20.19| Show InChI InChI=1S/C31H37NO11S/c1-14(33)38-13-22-26(39-15(2)34)27(40-16(3)35)28(41-17(4)36)30(42-22)44-23-9-7-19-20-12-18-6-8-21(37)25-24(18)31(19,29(23)43-25)10-11-32(20)5/h6-9,19-20,22-23,26-30,37H,10-13H2,1-5H3/t19-,20+,22?,23?,26?,27?,28?,29-,30?,31-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins by Competition binding assay				J Med Chem 59: 1052-67 (2016) BindingDB Entry DOI: 10.7270/Q2GB25XB
					More data for this Ligand-Target Pair