BDBM50382328 CHEMBL2022404

SMILES: CCOC(=O)C(C)(C)Oc1cccc(NC(=O)c2nn(c(c2C)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2Cl)c1

InChI Key: InChIKey=RHTSHAPSXDVMKC-UHFFFAOYSA-N

Data: 1 KI  2 EC50

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 3 hits for monomerid = 50382328   

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))	BDBM50382328 (CHEMBL2022404) Show SMILES CCOC(=O)C(C)(C)Oc1cccc(NC(=O)c2nn(c(c2C)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2Cl)c1 Show InChI InChI=1S/C29H26Cl3N3O4/c1-5-38-28(37)29(3,4)39-22-8-6-7-21(16-22)33-27(36)25-17(2)26(18-9-11-19(30)12-10-18)35(34-25)24-14-13-20(31)15-23(24)32/h6-16H,5H2,1-4H3,(H,33,36)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	65	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from CB1 receptor after 90 mins by liquid scintillation counting				ACS Med Chem Lett 2: 793-797 (2011) Article DOI: 10.1021/ml200091q BindingDB Entry DOI: 10.7270/Q2KK9CS1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha) (Homo sapiens (Human))	BDBM50382328 (CHEMBL2022404) Show SMILES CCOC(=O)C(C)(C)Oc1cccc(NC(=O)c2nn(c(c2C)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2Cl)c1 Show InChI InChI=1S/C29H26Cl3N3O4/c1-5-38-28(37)29(3,4)39-22-8-6-7-21(16-22)33-27(36)25-17(2)26(18-9-11-19(30)12-10-18)35(34-25)24-14-13-20(31)15-23(24)32/h6-16H,5H2,1-4H3,(H,33,36)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	743	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Agonist activity at human PPARalpha expressed in MCF7 cells co-transfected CPTI DR1-type RE after 16 hrs by luciferase reporter gene assay				ACS Med Chem Lett 2: 793-797 (2011) Article DOI: 10.1021/ml200091q BindingDB Entry DOI: 10.7270/Q2KK9CS1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha) (Homo sapiens (Human))	BDBM50382328 (CHEMBL2022404) Show SMILES CCOC(=O)C(C)(C)Oc1cccc(NC(=O)c2nn(c(c2C)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2Cl)c1 Show InChI InChI=1S/C29H26Cl3N3O4/c1-5-38-28(37)29(3,4)39-22-8-6-7-21(16-22)33-27(36)25-17(2)26(18-9-11-19(30)12-10-18)35(34-25)24-14-13-20(31)15-23(24)32/h6-16H,5H2,1-4H3,(H,33,36)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	856	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Agonist activity at human PPARalpha expressed in MCF7 cells co-transfected CPTI DR1-type RE after 6 hrs by luciferase reporter gene assay				ACS Med Chem Lett 2: 793-797 (2011) Article DOI: 10.1021/ml200091q BindingDB Entry DOI: 10.7270/Q2KK9CS1
					More data for this Ligand-Target Pair