BDBM50510012 CHEMBL4578199

SMILES: CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O

InChI Key: InChIKey=GFRHFFLFCWZVNO-UHFFFAOYSA-N

Data: 2 KI  2 IC50

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 4 hits for monomerid = 50510012   

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))	BDBM50510012 (CHEMBL4578199) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O |TLB:25:26:10.11:18.13,8:10:18.13:26.20,27:11:18.13:26.20,14:13:10.11:26.20,THB:21:20:10.11:18.13| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-8-13-27-24(28)22-20-16-9-6-7-10-17(16)21(23(22)25(27)29)19-14-15(26)11-12-18(19)20/h6-7,9-12,14,20-23H,2-5,8,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.74E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510012 (CHEMBL4578199) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O |TLB:25:26:10.11:18.13,8:10:18.13:26.20,27:11:18.13:26.20,14:13:10.11:26.20,THB:21:20:10.11:18.13| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-8-13-27-24(28)22-20-16-9-6-7-10-17(16)21(23(22)25(27)29)19-14-15(26)11-12-18(19)20/h6-7,9-12,14,20-23H,2-5,8,13H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510012 (CHEMBL4578199) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O |TLB:25:26:10.11:18.13,8:10:18.13:26.20,27:11:18.13:26.20,14:13:10.11:26.20,THB:21:20:10.11:18.13| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-8-13-27-24(28)22-20-16-9-6-7-10-17(16)21(23(22)25(27)29)19-14-15(26)11-12-18(19)20/h6-7,9-12,14,20-23H,2-5,8,13H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510012 (CHEMBL4578199) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O |TLB:25:26:10.11:18.13,8:10:18.13:26.20,27:11:18.13:26.20,14:13:10.11:26.20,THB:21:20:10.11:18.13| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-8-13-27-24(28)22-20-16-9-6-7-10-17(16)21(23(22)25(27)29)19-14-15(26)11-12-18(19)20/h6-7,9-12,14,20-23H,2-5,8,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594
					More data for this Ligand-Target Pair