BDBM50303832 (4-fluorophenyl)-((5aR,6S)-1-(4-fluorophenyl)-5a-methyl-5,5a,6,7,8,9-hexahydroimidazo[1,5-b]isoquinolin-6-yl)methanol::CHEMBL583858

SMILES: C[C@]12Cn3cnc(c3C=C1CCC[C@@H]2[C@H](O)c1ccc(F)cc1)-c1ccc(F)cc1

InChI Key: InChIKey=YXQPDNYJXVGIES-SDUSCBPUSA-N

Data: 3 KI  4 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 7 hits for monomerid = 50303832   

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
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50303832 ((4-fluorophenyl)-((5aR,6S)-1-(4-fluorophenyl)-5a-m...) Show SMILES C[C@]12Cn3cnc(c3C=C1CCC[C@@H]2[C@H](O)c1ccc(F)cc1)-c1ccc(F)cc1 |r,c:9| Show InChI InChI=1S/C25H24F2N2O/c1-25-14-29-15-28-23(16-5-9-19(26)10-6-16)22(29)13-18(25)3-2-4-21(25)24(30)17-7-11-20(27)12-8-17/h5-13,15,21,24,30H,2-4,14H2,1H3/t21-,24-,25+/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Displacement of GS-red from human glucocorticoid receptor by fluorescent polarization assay				J Med Chem 53: 1270-80 (2010) Article DOI: 10.1021/jm901551w BindingDB Entry DOI: 10.7270/Q2KS6SGW
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50303832 ((4-fluorophenyl)-((5aR,6S)-1-(4-fluorophenyl)-5a-m...) Show SMILES C[C@]12Cn3cnc(c3C=C1CCC[C@@H]2[C@H](O)c1ccc(F)cc1)-c1ccc(F)cc1 |r,c:9| Show InChI InChI=1S/C25H24F2N2O/c1-25-14-29-15-28-23(16-5-9-19(26)10-6-16)22(29)13-18(25)3-2-4-21(25)24(30)17-7-11-20(27)12-8-17/h5-13,15,21,24,30H,2-4,14H2,1H3/t21-,24-,25+/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Displacement of GS-red from human glucocorticoid receptor by fluorescent polarization assay				J Med Chem 53: 1270-80 (2010) Article DOI: 10.1021/jm901551w BindingDB Entry DOI: 10.7270/Q2KS6SGW
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50303832 ((4-fluorophenyl)-((5aR,6S)-1-(4-fluorophenyl)-5a-m...) Show SMILES C[C@]12Cn3cnc(c3C=C1CCC[C@@H]2[C@H](O)c1ccc(F)cc1)-c1ccc(F)cc1 |r,c:9| Show InChI InChI=1S/C25H24F2N2O/c1-25-14-29-15-28-23(16-5-9-19(26)10-6-16)22(29)13-18(25)3-2-4-21(25)24(30)17-7-11-20(27)12-8-17/h5-13,15,21,24,30H,2-4,14H2,1H3/t21-,24-,25+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	451	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Binding affinity to progesterone receptor				J Med Chem 53: 1270-80 (2010) Article DOI: 10.1021/jm901551w BindingDB Entry DOI: 10.7270/Q2KS6SGW
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50303832 ((4-fluorophenyl)-((5aR,6S)-1-(4-fluorophenyl)-5a-m...) Show SMILES C[C@]12Cn3cnc(c3C=C1CCC[C@@H]2[C@H](O)c1ccc(F)cc1)-c1ccc(F)cc1 |r,c:9| Show InChI InChI=1S/C25H24F2N2O/c1-25-14-29-15-28-23(16-5-9-19(26)10-6-16)22(29)13-18(25)3-2-4-21(25)24(30)17-7-11-20(27)12-8-17/h5-13,15,21,24,30H,2-4,14H2,1H3/t21-,24-,25+/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	243	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transrepression activity at glucocorticoid receptor expressed in human A549 cells assessed as inhibition of IL-1-beta-induced NF-kappaB dependent E-s...				J Med Chem 53: 1270-80 (2010) Article DOI: 10.1021/jm901551w BindingDB Entry DOI: 10.7270/Q2KS6SGW
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50303832 ((4-fluorophenyl)-((5aR,6S)-1-(4-fluorophenyl)-5a-m...) Show SMILES C[C@]12Cn3cnc(c3C=C1CCC[C@@H]2[C@H](O)c1ccc(F)cc1)-c1ccc(F)cc1 |r,c:9| Show InChI InChI=1S/C25H24F2N2O/c1-25-14-29-15-28-23(16-5-9-19(26)10-6-16)22(29)13-18(25)3-2-4-21(25)24(30)17-7-11-20(27)12-8-17/h5-13,15,21,24,30H,2-4,14H2,1H3/t21-,24-,25+/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	272	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transrepression activity at glucocorticoid receptor expressed in human A549 cells assessed as inhibition of PMA-induced AP1 activity after 6 hrs by l...				J Med Chem 53: 1270-80 (2010) Article DOI: 10.1021/jm901551w BindingDB Entry DOI: 10.7270/Q2KS6SGW
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50303832 ((4-fluorophenyl)-((5aR,6S)-1-(4-fluorophenyl)-5a-m...) Show SMILES C[C@]12Cn3cnc(c3C=C1CCC[C@@H]2[C@H](O)c1ccc(F)cc1)-c1ccc(F)cc1 |r,c:9| Show InChI InChI=1S/C25H24F2N2O/c1-25-14-29-15-28-23(16-5-9-19(26)10-6-16)22(29)13-18(25)3-2-4-21(25)24(30)17-7-11-20(27)12-8-17/h5-13,15,21,24,30H,2-4,14H2,1H3/t21-,24-,25+/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transrepression activity at glucocorticoid receptor expressed in human A549 cells assessed as inhibition of PMA-induced AP1 activity after 6 hrs by l...				J Med Chem 53: 1270-80 (2010) Article DOI: 10.1021/jm901551w BindingDB Entry DOI: 10.7270/Q2KS6SGW
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50303832 ((4-fluorophenyl)-((5aR,6S)-1-(4-fluorophenyl)-5a-m...) Show SMILES C[C@]12Cn3cnc(c3C=C1CCC[C@@H]2[C@H](O)c1ccc(F)cc1)-c1ccc(F)cc1 |r,c:9| Show InChI InChI=1S/C25H24F2N2O/c1-25-14-29-15-28-23(16-5-9-19(26)10-6-16)22(29)13-18(25)3-2-4-21(25)24(30)17-7-11-20(27)12-8-17/h5-13,15,21,24,30H,2-4,14H2,1H3/t21-,24-,25+/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transrepression activity at glucocorticoid receptor expressed in human A549 cells assessed as inhibition of IL-1-beta-induced NF-kappaB dependent E-s...				J Med Chem 53: 1270-80 (2010) Article DOI: 10.1021/jm901551w BindingDB Entry DOI: 10.7270/Q2KS6SGW
					More data for this Ligand-Target Pair