BDBM50203421 CHEMBL3964502

SMILES: C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O

InChI Key: InChIKey=WWWKKFOVJNHTTL-LMKMVOKYSA-N

Data: 7 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 7 hits for monomerid = 50203421   

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
Estrogen receptor (Homo sapiens (Human))	BDBM50203421 (CHEMBL3964502) Show SMILES C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r| Show InChI InChI=1S/C25H24FN3O5S/c1-16(28-24(31)15-30)25(17-3-10-22(11-4-17)35(2,32)33)34-21-9-12-23-18(13-21)14-27-29(23)20-7-5-19(26)6-8-20/h3-14,16,25,30H,15H2,1-2H3,(H,28,31)/t16-,25-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) by FP assay				Bioorg Med Chem Lett 26: 5741-5748 (2016) Article DOI: 10.1016/j.bmcl.2016.10.052 BindingDB Entry DOI: 10.7270/Q2NP26D1
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50203421 (CHEMBL3964502) Show SMILES C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r| Show InChI InChI=1S/C25H24FN3O5S/c1-16(28-24(31)15-30)25(17-3-10-22(11-4-17)35(2,32)33)34-21-9-12-23-18(13-21)14-27-29(23)20-7-5-19(26)6-8-20/h3-14,16,25,30H,15H2,1-2H3,(H,28,31)/t16-,25-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Binding affinity to GR (unknown origin) by FP assay				Bioorg Med Chem Lett 26: 5741-5748 (2016) Article DOI: 10.1016/j.bmcl.2016.10.052 BindingDB Entry DOI: 10.7270/Q2NP26D1
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50203421 (CHEMBL3964502) Show SMILES C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r| Show InChI InChI=1S/C25H24FN3O5S/c1-16(28-24(31)15-30)25(17-3-10-22(11-4-17)35(2,32)33)34-21-9-12-23-18(13-21)14-27-29(23)20-7-5-19(26)6-8-20/h3-14,16,25,30H,15H2,1-2H3,(H,28,31)/t16-,25-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.840	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Agonist activity at glucocorticoid receptor in human ChaGoK1 cells assessed as inhibition of AP1-mediated transcriptional activity by measuring reduc...				Bioorg Med Chem Lett 26: 5741-5748 (2016) Article DOI: 10.1016/j.bmcl.2016.10.052 BindingDB Entry DOI: 10.7270/Q2NP26D1
					More data for this Ligand-Target Pair
Androgen Receptor (Homo sapiens (Human))	BDBM50203421 (CHEMBL3964502) Show SMILES C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r| Show InChI InChI=1S/C25H24FN3O5S/c1-16(28-24(31)15-30)25(17-3-10-22(11-4-17)35(2,32)33)34-21-9-12-23-18(13-21)14-27-29(23)20-7-5-19(26)6-8-20/h3-14,16,25,30H,15H2,1-2H3,(H,28,31)/t16-,25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Binding affinity to AR (unknown origin) by FP assay				Bioorg Med Chem Lett 26: 5741-5748 (2016) Article DOI: 10.1016/j.bmcl.2016.10.052 BindingDB Entry DOI: 10.7270/Q2NP26D1
					More data for this Ligand-Target Pair
Estradiol receptor beta (ERβ) (Homo sapiens (Human))	BDBM50203421 (CHEMBL3964502) Show SMILES C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r| Show InChI InChI=1S/C25H24FN3O5S/c1-16(28-24(31)15-30)25(17-3-10-22(11-4-17)35(2,32)33)34-21-9-12-23-18(13-21)14-27-29(23)20-7-5-19(26)6-8-20/h3-14,16,25,30H,15H2,1-2H3,(H,28,31)/t16-,25-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) by FP assay				Bioorg Med Chem Lett 26: 5741-5748 (2016) Article DOI: 10.1016/j.bmcl.2016.10.052 BindingDB Entry DOI: 10.7270/Q2NP26D1
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50203421 (CHEMBL3964502) Show SMILES C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r| Show InChI InChI=1S/C25H24FN3O5S/c1-16(28-24(31)15-30)25(17-3-10-22(11-4-17)35(2,32)33)34-21-9-12-23-18(13-21)14-27-29(23)20-7-5-19(26)6-8-20/h3-14,16,25,30H,15H2,1-2H3,(H,28,31)/t16-,25-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Binding affinity to PR (unknown origin) by FP assay				Bioorg Med Chem Lett 26: 5741-5748 (2016) Article DOI: 10.1016/j.bmcl.2016.10.052 BindingDB Entry DOI: 10.7270/Q2NP26D1
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50203421 (CHEMBL3964502) Show SMILES C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r| Show InChI InChI=1S/C25H24FN3O5S/c1-16(28-24(31)15-30)25(17-3-10-22(11-4-17)35(2,32)33)34-21-9-12-23-18(13-21)14-27-29(23)20-7-5-19(26)6-8-20/h3-14,16,25,30H,15H2,1-2H3,(H,28,31)/t16-,25-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of 3H-aldosterone from MR (unknown origin) ligand binding domain by SPA assay				Bioorg Med Chem Lett 26: 5741-5748 (2016) Article DOI: 10.1016/j.bmcl.2016.10.052 BindingDB Entry DOI: 10.7270/Q2NP26D1
					More data for this Ligand-Target Pair