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SMILES: O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1

InChI Key: InChIKey=IEJRHMSEVCJOEN-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50359653   

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
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50359653 (CHEMBL1928869) Show SMILES O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1 |t:13| Show InChI InChI=1S/C12H9N5O2S/c18-11-4-19-10-2-1-7(3-8(10)14-11)9-5-20-12-15-13-6-17(12)16-9/h1-3,6H,4-5H2,(H,14,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]aldosterone from cytosolic human MR expressed in HEK293 cells after 16 hrs by scintillation counting				J Med Chem 54: 8616-31 (2011) Article DOI: 10.1021/jm2011645 BindingDB Entry DOI: 10.7270/Q21G0MP5
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50359653 (CHEMBL1928869) Show SMILES O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1 |t:13| Show InChI InChI=1S/C12H9N5O2S/c18-11-4-19-10-2-1-7(3-8(10)14-11)9-5-20-12-15-13-6-17(12)16-9/h1-3,6H,4-5H2,(H,14,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]dexomethasone from GR				J Med Chem 54: 8616-31 (2011) Article DOI: 10.1021/jm2011645 BindingDB Entry DOI: 10.7270/Q21G0MP5
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50359653 (CHEMBL1928869) Show SMILES O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1 |t:13| Show InChI InChI=1S/C12H9N5O2S/c18-11-4-19-10-2-1-7(3-8(10)14-11)9-5-20-12-15-13-6-17(12)16-9/h1-3,6H,4-5H2,(H,14,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]progestrone from PR				J Med Chem 54: 8616-31 (2011) Article DOI: 10.1021/jm2011645 BindingDB Entry DOI: 10.7270/Q21G0MP5
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50359653 (CHEMBL1928869) Show SMILES O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1 |t:13| Show InChI InChI=1S/C12H9N5O2S/c18-11-4-19-10-2-1-7(3-8(10)14-11)9-5-20-12-15-13-6-17(12)16-9/h1-3,6H,4-5H2,(H,14,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]testosterone from AR				J Med Chem 54: 8616-31 (2011) Article DOI: 10.1021/jm2011645 BindingDB Entry DOI: 10.7270/Q21G0MP5
					More data for this Ligand-Target Pair