null

SMILES: COc1ccc(OC)c(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)c1

InChI Key: InChIKey=DUIMJHGQWFVERX-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 38882   

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
Isoform 2 of Nuclear receptor ROR-alpha (Alpha-2) (Homo sapiens (Human))	BDBM38882 (MLS000079343 | N-(2,5-dimethoxyphenyl)-4-(2-ketopy...) Show SMILES COc1ccc(OC)c(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)c1 Show InChI InChI=1S/C18H20N2O5S/c1-24-14-7-10-17(25-2)16(12-14)19-26(22,23)15-8-5-13(6-9-15)20-11-3-4-18(20)21/h5-10,12,19H,3-4,11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q26Q1VNZ
					More data for this Ligand-Target Pair
High affinity choline transporter 1 (Homo sapiens (Human))	BDBM38882 (MLS000079343 | N-(2,5-dimethoxyphenyl)-4-(2-ketopy...) Show SMILES COc1ccc(OC)c(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)c1 Show InChI InChI=1S/C18H20N2O5S/c1-24-14-7-10-17(25-2)16(12-14)19-26(22,23)15-8-5-13(6-9-15)20-11-3-4-18(20)21/h5-10,12,19H,3-4,11H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	2.22E+4	n/a	n/a	n/a	n/a
Johns Hopkins Ion Channel Center Curated by PubChem BioAssay					Assay Description Data Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center Affiliation: Johns Hopkins University, School of Medicine Screening ...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q21N7ZQ4
					More data for this Ligand-Target Pair
Steroidogenic factor 1 (Homo sapiens (Human))	BDBM38882 (MLS000079343 | N-(2,5-dimethoxyphenyl)-4-(2-ketopy...) Show SMILES COc1ccc(OC)c(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)c1 Show InChI InChI=1S/C18H20N2O5S/c1-24-14-7-10-17(25-2)16(12-14)19-26(22,23)15-8-5-13(6-9-15)20-11-3-4-18(20)21/h5-10,12,19H,3-4,11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2319T8T
					More data for this Ligand-Target Pair