BDBM50129145 9-Fluoro-2,2,4-trimethyl-5-((Z)-3-methyl-but-2-enylidene)-2,5-dihydro-1H-6-oxa-1-aza-chrysene::CHEMBL65690

SMILES: [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-1/[#8]-c2ccc(F)cc2-c2ccc3-[#7]C([#6])([#6])[#6]=[#6](-[#6])-c3c-12

InChI Key: InChIKey=VRWXHHASXOUVMH-FBHDLOMBSA-N

Data: 1 KI  4 IC50  1 EC50

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 6 hits for monomerid = 50129145   

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
Progesterone receptor (Homo sapiens (Human))	BDBM50129145 (9-Fluoro-2,2,4-trimethyl-5-((Z)-3-methyl-but-2-eny...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-1/[#8]-c2ccc(F)cc2-c2ccc3-[#7]C([#6])([#6])[#6]=[#6](-[#6])-c3c-12 |t:23| Show InChI InChI=1S/C24H24FNO/c1-14(2)6-10-21-23-17(18-12-16(25)7-11-20(18)27-21)8-9-19-22(23)15(3)13-24(4,5)26-19/h6-13,26H,1-5H3/b21-10-	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity for human progesterone receptor; Not active				Bioorg Med Chem Lett 13: 2071-4 (2003) BindingDB Entry DOI: 10.7270/Q2SX6DSM
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50129145 (9-Fluoro-2,2,4-trimethyl-5-((Z)-3-methyl-but-2-eny...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-1/[#8]-c2ccc(F)cc2-c2ccc3-[#7]C([#6])([#6])[#6]=[#6](-[#6])-c3c-12 |t:23| Show InChI InChI=1S/C24H24FNO/c1-14(2)6-10-21-23-17(18-12-16(25)7-11-20(18)27-21)8-9-19-22(23)15(3)13-24(4,5)26-19/h6-13,26H,1-5H3/b21-10-	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory activity against human Estrogen receptor; not active				Bioorg Med Chem Lett 13: 2071-4 (2003) BindingDB Entry DOI: 10.7270/Q2SX6DSM
					More data for this Ligand-Target Pair
Androgen Receptor (Homo sapiens (Human))	BDBM50129145 (9-Fluoro-2,2,4-trimethyl-5-((Z)-3-methyl-but-2-eny...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-1/[#8]-c2ccc(F)cc2-c2ccc3-[#7]C([#6])([#6])[#6]=[#6](-[#6])-c3c-12 |t:23| Show InChI InChI=1S/C24H24FNO/c1-14(2)6-10-21-23-17(18-12-16(25)7-11-20(18)27-21)8-9-19-22(23)15(3)13-24(4,5)26-19/h6-13,26H,1-5H3/b21-10-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Antagonist activity against Androgen receptor; not active				Bioorg Med Chem Lett 13: 2071-4 (2003) BindingDB Entry DOI: 10.7270/Q2SX6DSM
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50129145 (9-Fluoro-2,2,4-trimethyl-5-((Z)-3-methyl-but-2-eny...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-1/[#8]-c2ccc(F)cc2-c2ccc3-[#7]C([#6])([#6])[#6]=[#6](-[#6])-c3c-12 |t:23| Show InChI InChI=1S/C24H24FNO/c1-14(2)6-10-21-23-17(18-12-16(25)7-11-20(18)27-21)8-9-19-22(23)15(3)13-24(4,5)26-19/h6-13,26H,1-5H3/b21-10-	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.70	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Effective concentration for agonist activity towards human progesterone receptor (hPR) using the cotransfection assay in CV-1 cells				Bioorg Med Chem Lett 13: 2071-4 (2003) BindingDB Entry DOI: 10.7270/Q2SX6DSM
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50129145 (9-Fluoro-2,2,4-trimethyl-5-((Z)-3-methyl-but-2-eny...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-1/[#8]-c2ccc(F)cc2-c2ccc3-[#7]C([#6])([#6])[#6]=[#6](-[#6])-c3c-12 |t:23| Show InChI InChI=1S/C24H24FNO/c1-14(2)6-10-21-23-17(18-12-16(25)7-11-20(18)27-21)8-9-19-22(23)15(3)13-24(4,5)26-19/h6-13,26H,1-5H3/b21-10-	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	177	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Antagonist activity at glucocorticoid (hGR) receptor				Bioorg Med Chem Lett 13: 2071-4 (2003) BindingDB Entry DOI: 10.7270/Q2SX6DSM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50129145 (9-Fluoro-2,2,4-trimethyl-5-((Z)-3-methyl-but-2-eny...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]=[#6]-1/[#8]-c2ccc(F)cc2-c2ccc3-[#7]C([#6])([#6])[#6]=[#6](-[#6])-c3c-12 |t:23| Show InChI InChI=1S/C24H24FNO/c1-14(2)6-10-21-23-17(18-12-16(25)7-11-20(18)27-21)8-9-19-22(23)15(3)13-24(4,5)26-19/h6-13,26H,1-5H3/b21-10-	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (hMR); not active				Bioorg Med Chem Lett 13: 2071-4 (2003) BindingDB Entry DOI: 10.7270/Q2SX6DSM
					More data for this Ligand-Target Pair