BDBM50450493 CHEMBL4164152::US10597366, Compound 131

SMILES: FC(F)S(=O)(=O)c1ccc(Oc2cc(F)cc(Cl)c2)c(Br)c1

InChI Key: InChIKey=WITZLNUQRNWZDI-UHFFFAOYSA-N

Data: 2 IC50  1 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 = 50450493   

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
Endothelial PAS domain-containing protein 1 (Homo sapiens (Human))	BDBM50450493 (CHEMBL4164152 | US10597366, Compound 131) Show SMILES FC(F)S(=O)(=O)c1ccc(Oc2cc(F)cc(Cl)c2)c(Br)c1 Show InChI InChI=1S/C13H7BrClF3O3S/c14-11-6-10(22(19,20)13(17)18)1-2-12(11)21-9-4-7(15)3-8(16)5-9/h1-6,13H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Peloton Therapeutics, Inc. Curated by ChEMBL					Assay Description Binding affinity to His-tagged HIF-2alpha PAS-B domain (unknown origin) after 2 hrs by scintillation proximity assay				J Med Chem 61: 9691-9721 (2018) Article DOI: 10.1021/acs.jmedchem.8b01196 BindingDB Entry DOI: 10.7270/Q2H997RJ
					More data for this Ligand-Target Pair
Endothelial PAS domain-containing protein 1 (Homo sapiens (Human))	BDBM50450493 (CHEMBL4164152 | US10597366, Compound 131) Show SMILES FC(F)S(=O)(=O)c1ccc(Oc2cc(F)cc(Cl)c2)c(Br)c1 Show InChI InChI=1S/C13H7BrClF3O3S/c14-11-6-10(22(19,20)13(17)18)1-2-12(11)21-9-4-7(15)3-8(16)5-9/h1-6,13H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Peloton Therapeutics, Inc. US Patent					Assay Description HIF-2a: The total assay volume was about 100 uL in the following configuration: 2 uL compound in 100% DMSO, 88 uL buffer with protein and probe and 1...				US Patent US10597366 (2020)
					More data for this Ligand-Target Pair
Endothelial PAS domain-containing protein 1 (Homo sapiens (Human))	BDBM50450493 (CHEMBL4164152 | US10597366, Compound 131) Show SMILES FC(F)S(=O)(=O)c1ccc(Oc2cc(F)cc(Cl)c2)c(Br)c1 Show InChI InChI=1S/C13H7BrClF3O3S/c14-11-6-10(22(19,20)13(17)18)1-2-12(11)21-9-4-7(15)3-8(16)5-9/h1-6,13H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a
Peloton Therapeutics, Inc. Curated by ChEMBL					Assay Description Antagonist activity at HIF-2alpha in human 786-O cells co-expressing HIF responsive element after 24 hrs by ONE-Glo luciferase reporter gene assay				J Med Chem 61: 9691-9721 (2018) Article DOI: 10.1021/acs.jmedchem.8b01196 BindingDB Entry DOI: 10.7270/Q2H997RJ
					More data for this Ligand-Target Pair