BDBM50450494 CHEMBL4175756::US10597366, Compound 44

SMILES: COCc1c(Cl)c(Oc2cc(F)cc(Cl)c2)ccc1S(=O)(=O)C(F)F

InChI Key: InChIKey=WOPUMZLBYDMMAB-UHFFFAOYSA-N

Data: 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 2 hits for monomerid = 50450494   

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))	BDBM50450494 (CHEMBL4175756 | US10597366, Compound 44) Show SMILES COCc1c(Cl)c(Oc2cc(F)cc(Cl)c2)ccc1S(=O)(=O)C(F)F Show InChI InChI=1S/C15H11Cl2F3O4S/c1-23-7-11-13(25(21,22)15(19)20)3-2-12(14(11)17)24-10-5-8(16)4-9(18)6-10/h2-6,15H,7H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.80E+3	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))	BDBM50450494 (CHEMBL4175756 | US10597366, Compound 44) Show SMILES COCc1c(Cl)c(Oc2cc(F)cc(Cl)c2)ccc1S(=O)(=O)C(F)F Show InChI InChI=1S/C15H11Cl2F3O4S/c1-23-7-11-13(25(21,22)15(19)20)3-2-12(14(11)17)24-10-5-8(16)4-9(18)6-10/h2-6,15H,7H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.20E+3	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