BDBM486281 US10947203, No. LC-82

SMILES: COc1ccc(O)cc1-n1nnc(c1C)S(=O)(=O)c1ccc(c(O)c1)C(C)(C)C

InChI Key: InChIKey=UNGPHIHVYYGYJO-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 = 486281   

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
Pregnane X receptor (Homo sapiens (Human))	BDBM486281 (US10947203, No. LC-82) Show SMILES COc1ccc(O)cc1-n1nnc(c1C)S(=O)(=O)c1ccc(c(O)c1)C(C)(C)C Show InChI InChI=1S/C20H23N3O5S/c1-12-19(21-22-23(12)16-10-13(24)6-9-18(16)28-5)29(26,27)14-7-8-15(17(25)11-14)20(2,3)4/h6-11,24-25H,1-5H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
ST. JUDE CHILDREN''S RSEARCH HOSPITAL US Patent					Assay Description The hPXR transactivation assays (PXR agonistic and antagonistic assays) were performed in the HepG2 cells stably expressing FLAG-hPXR and CYP3A4-luci...				US Patent US10947203 (2021)
					More data for this Ligand-Target Pair
Pregnane X receptor (Homo sapiens (Human))	BDBM486281 (US10947203, No. LC-82) Show SMILES COc1ccc(O)cc1-n1nnc(c1C)S(=O)(=O)c1ccc(c(O)c1)C(C)(C)C Show InChI InChI=1S/C20H23N3O5S/c1-12-19(21-22-23(12)16-10-13(24)6-9-18(16)28-5)29(26,27)14-7-8-15(17(25)11-14)20(2,3)4/h6-11,24-25H,1-5H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
ST. JUDE CHILDREN''S RSEARCH HOSPITAL US Patent					Assay Description The time-resolved fluorescence resonance transfer (TR-FRET) hPXR competitive binding assay was performed according to the manufacturer's instruct...				US Patent US10947203 (2021)
					More data for this Ligand-Target Pair