BDBM50072716 9-Chloro-2,2,4-trimethyl-5-propoxy-2,5-dihydro-1H-6-oxa-1-aza-chrysene::CHEMBL116221

SMILES: CCCOC1Oc2ccc(Cl)cc2-c2ccc3NC(C)(C)C=C(C)c3c12

InChI Key: InChIKey=UDYVQHLPMVKSOP-UHFFFAOYSA-N

Data: 3 KI  2 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 5 hits for monomerid = 50072716   

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))	BDBM50072716 (9-Chloro-2,2,4-trimethyl-5-propoxy-2,5-dihydro-1H-...) Show SMILES CCCOC1Oc2ccc(Cl)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:22| Show InChI InChI=1S/C22H24ClNO2/c1-5-10-25-21-20-15(16-11-14(23)6-9-18(16)26-21)7-8-17-19(20)13(2)12-22(3,4)24-17/h6-9,11-12,21,24H,5,10H2,1-4H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Binding affinity was determined against hPR-A (human progesterone receptor) using progesterone radioligand in competitive binding assay				Bioorg Med Chem Lett 8: 3365-70 (1999) BindingDB Entry DOI: 10.7270/Q2BC402X
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50072716 (9-Chloro-2,2,4-trimethyl-5-propoxy-2,5-dihydro-1H-...) Show SMILES CCCOC1Oc2ccc(Cl)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:22| Show InChI InChI=1S/C22H24ClNO2/c1-5-10-25-21-20-15(16-11-14(23)6-9-18(16)26-21)7-8-17-19(20)13(2)12-22(3,4)24-17/h6-9,11-12,21,24H,5,10H2,1-4H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	260	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Displacement of Dexamethasone from human glucocorticoid receptor				Bioorg Med Chem Lett 8: 3365-70 (1999) BindingDB Entry DOI: 10.7270/Q2BC402X
					More data for this Ligand-Target Pair
Androgen Receptor (Homo sapiens (Human))	BDBM50072716 (9-Chloro-2,2,4-trimethyl-5-propoxy-2,5-dihydro-1H-...) Show SMILES CCCOC1Oc2ccc(Cl)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:22| Show InChI InChI=1S/C22H24ClNO2/c1-5-10-25-21-20-15(16-11-14(23)6-9-18(16)26-21)7-8-17-19(20)13(2)12-22(3,4)24-17/h6-9,11-12,21,24H,5,10H2,1-4H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	697	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Displacement of DHT from human androgen receptor				Bioorg Med Chem Lett 8: 3365-70 (1999) BindingDB Entry DOI: 10.7270/Q2BC402X
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50072716 (9-Chloro-2,2,4-trimethyl-5-propoxy-2,5-dihydro-1H-...) Show SMILES CCCOC1Oc2ccc(Cl)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:22| Show InChI InChI=1S/C22H24ClNO2/c1-5-10-25-21-20-15(16-11-14(23)6-9-18(16)26-21)7-8-17-19(20)13(2)12-22(3,4)24-17/h6-9,11-12,21,24H,5,10H2,1-4H3	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	>1.00E+4	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Antagonist activity against hPR (human progesterone receptor) compared to that of progesterone (100%)				Bioorg Med Chem Lett 8: 3365-70 (1999) BindingDB Entry DOI: 10.7270/Q2BC402X
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50072716 (9-Chloro-2,2,4-trimethyl-5-propoxy-2,5-dihydro-1H-...) Show SMILES CCCOC1Oc2ccc(Cl)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:22| Show InChI InChI=1S/C22H24ClNO2/c1-5-10-25-21-20-15(16-11-14(23)6-9-18(16)26-21)7-8-17-19(20)13(2)12-22(3,4)24-17/h6-9,11-12,21,24H,5,10H2,1-4H3	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	14	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Agonist activity was determined against hPR (human progesterone receptor) compared to that of progesterone (100%)				Bioorg Med Chem Lett 8: 3365-70 (1999) BindingDB Entry DOI: 10.7270/Q2BC402X
					More data for this Ligand-Target Pair