Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 299.3 BDBM50355239

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 4 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Progesterone receptor (Homo sapiens (Human))	BDBM50355239 (CHEMBL1835832) Show SMILES CCN(CC)c1cc2oc(=O)ccc2cc1-c1cccs1 Show InChI InChI=1S/C17H17NO2S/c1-3-18(4-2)14-11-15-12(7-8-17(19)20-15)10-13(14)16-6-5-9-21-16/h5-11H,3-4H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Ochanomizu University Curated by ChEMBL					Assay Description Antagonist activity at human progesterone receptor in T47D cells after 24 hrs by alkaline phosphatase assay				J Med Chem 54: 7055-65 (2011) Article DOI: 10.1021/jm2005404 BindingDB Entry DOI: 10.7270/Q27D2VJ6
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50355239 (CHEMBL1835832) Show SMILES CCN(CC)c1cc2oc(=O)ccc2cc1-c1cccs1 Show InChI InChI=1S/C17H17NO2S/c1-3-18(4-2)14-11-15-12(7-8-17(19)20-15)10-13(14)16-6-5-9-21-16/h5-11H,3-4H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ochanomizu University Curated by ChEMBL					Assay Description Displacement of [1,2,6,7-3H]PG from human PR-LBD after 24 hrs by liquid scintillation counting				J Med Chem 54: 7055-65 (2011) Article DOI: 10.1021/jm2005404 BindingDB Entry DOI: 10.7270/Q27D2VJ6
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50355239 (CHEMBL1835832) Show SMILES CCN(CC)c1cc2oc(=O)ccc2cc1-c1cccs1 Show InChI InChI=1S/C17H17NO2S/c1-3-18(4-2)14-11-15-12(7-8-17(19)20-15)10-13(14)16-6-5-9-21-16/h5-11H,3-4H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.96E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ochanomizu University Curated by ChEMBL					Assay Description Displacement of [3H]-dexamethasone from human recombinant glucocorticoid receptor after 18 hrs by liquid scintillation counting				J Med Chem 54: 7055-65 (2011) Article DOI: 10.1021/jm2005404 BindingDB Entry DOI: 10.7270/Q27D2VJ6
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50355239 (CHEMBL1835832) Show SMILES CCN(CC)c1cc2oc(=O)ccc2cc1-c1cccs1 Show InChI InChI=1S/C17H17NO2S/c1-3-18(4-2)14-11-15-12(7-8-17(19)20-15)10-13(14)16-6-5-9-21-16/h5-11H,3-4H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ochanomizu University Curated by ChEMBL					Assay Description Displacement of [3H]DHT from human recombinant androgen receptor-LBD expressed in Escherichia coli after 18 hrs by liquid scintillation counting				J Med Chem 54: 7055-65 (2011) Article DOI: 10.1021/jm2005404 BindingDB Entry DOI: 10.7270/Q27D2VJ6
					More data for this Ligand-Target Pair