BDBM50383389 CHEMBL2030739

SMILES: CCNC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(N)=O

InChI Key: InChIKey=DUWHBNLZCXTBMM-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 = 50383389   

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))	BDBM50383389 (CHEMBL2030739) Show SMILES CCNC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(N)=O Show InChI InChI=1S/C25H26Cl3N5O2/c1-3-30-25(24(29)35)10-12-32(13-11-25)23(34)21-15(2)22(16-4-6-17(26)7-5-16)33(31-21)20-9-8-18(27)14-19(20)28/h4-9,14,30H,3,10-13H2,1-2H3,(H2,29,35)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	78.4	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))	BDBM50383389 (CHEMBL2030739) Show SMILES CCNC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(N)=O Show InChI InChI=1S/C25H26Cl3N5O2/c1-3-30-25(24(29)35)10-12-32(13-11-25)23(34)21-15(2)22(16-4-6-17(26)7-5-16)33(31-21)20-9-8-18(27)14-19(20)28/h4-9,14,30H,3,10-13H2,1-2H3,(H2,29,35)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.22E+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