BDBM50144617 CHEMBL3759440

SMILES: CCCCC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl

InChI Key: InChIKey=JNBUHFRZFFTKQK-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 = 50144617   

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))	BDBM50144617 (CHEMBL3759440) Show SMILES CCCCC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C27H29Cl3N4O2/c1-3-4-5-24(35)33-14-12-21(13-15-33)31-27(36)25-17(2)26(18-6-8-19(28)9-7-18)34(32-25)23-11-10-20(29)16-22(23)30/h6-11,16,21H,3-5,12-15H2,1-2H3,(H,31,36)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cell membranes				Bioorg Med Chem 24: 1063-70 (2016) BindingDB Entry DOI: 10.7270/Q2GB25WW
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50144617 (CHEMBL3759440) Show SMILES CCCCC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C27H29Cl3N4O2/c1-3-4-5-24(35)33-14-12-21(13-15-33)31-27(36)25-17(2)26(18-6-8-19(28)9-7-18)34(32-25)23-11-10-20(29)16-22(23)30/h6-11,16,21H,3-5,12-15H2,1-2H3,(H,31,36)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	1.79E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cell membranes				Bioorg Med Chem 24: 1063-70 (2016) BindingDB Entry DOI: 10.7270/Q2GB25WW
					More data for this Ligand-Target Pair