BDBM50383396 CHEMBL2030748

SMILES: CCCCCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1

InChI Key: InChIKey=CICAAZMGCVKLJQ-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 = 50383396   

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 1 (Homo sapiens (Human))	BDBM50383396 (CHEMBL2030748) Show SMILES CCCCCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C35H38Cl3N5O2/c1-3-4-5-9-20-39-34(45)40-35(26-10-7-6-8-11-26)18-21-42(22-19-35)33(44)31-24(2)32(25-12-14-27(36)15-13-25)43(41-31)30-17-16-28(37)23-29(30)38/h6-8,10-17,23H,3-5,9,18-22H2,1-2H3,(H2,39,40,45)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	38.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells				J Med Chem 55: 2820-34 (2012) Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50383396 (CHEMBL2030748) Show SMILES CCCCCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C35H38Cl3N5O2/c1-3-4-5-9-20-39-34(45)40-35(26-10-7-6-8-11-26)18-21-42(22-19-35)33(44)31-24(2)32(25-12-14-27(36)15-13-25)43(41-31)30-17-16-28(37)23-29(30)38/h6-8,10-17,23H,3-5,9,18-22H2,1-2H3,(H2,39,40,45)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.41E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells				J Med Chem 55: 2820-34 (2012) Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z
					More data for this Ligand-Target Pair