BDBM50303812 (S)-1-(5-Chlorothiophen-2-yl)-1-((5aR,6S)-1-(4-fluorophenyl)-5a-methyl-5,5a,6,7,8,9-hexahydroimidazo[1,5-b]isoquinolin-6-yl)-ethanol::CHEMBL572330

SMILES: C[C@](O)([C@H]1CCCC2=Cc3c(ncn3C[C@]12C)-c1ccc(F)cc1)c1ccc(Cl)s1

InChI Key: InChIKey=FBHBBILQSLGKPC-IGKWTDBASA-N

Data: 2 KI  1 IC50  3 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 = 50303812   

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))	BDBM50303812 ((S)-1-(5-Chlorothiophen-2-yl)-1-((5aR,6S)-1-(4-flu...) Show SMILES C[C@](O)([C@H]1CCCC2=Cc3c(ncn3C[C@]12C)-c1ccc(F)cc1)c1ccc(Cl)s1 |r,t:7| Show InChI InChI=1S/C24H24ClFN2OS/c1-23-13-28-14-27-22(15-6-8-17(26)9-7-15)18(28)12-16(23)4-3-5-19(23)24(2,29)20-10-11-21(25)30-20/h6-12,14,19,29H,3-5,13H2,1-2H3/t19-,23-,24-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	4	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))	BDBM50303812 ((S)-1-(5-Chlorothiophen-2-yl)-1-((5aR,6S)-1-(4-flu...) Show SMILES C[C@](O)([C@H]1CCCC2=Cc3c(ncn3C[C@]12C)-c1ccc(F)cc1)c1ccc(Cl)s1 |r,t:7| Show InChI InChI=1S/C24H24ClFN2OS/c1-23-13-28-14-27-22(15-6-8-17(26)9-7-15)18(28)12-16(23)4-3-5-19(23)24(2,29)20-10-11-21(25)30-20/h6-12,14,19,29H,3-5,13H2,1-2H3/t19-,23-,24-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	409	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))	BDBM50303812 ((S)-1-(5-Chlorothiophen-2-yl)-1-((5aR,6S)-1-(4-flu...) Show SMILES C[C@](O)([C@H]1CCCC2=Cc3c(ncn3C[C@]12C)-c1ccc(F)cc1)c1ccc(Cl)s1 |r,t:7| Show InChI InChI=1S/C24H24ClFN2OS/c1-23-13-28-14-27-22(15-6-8-17(26)9-7-15)18(28)12-16(23)4-3-5-19(23)24(2,29)20-10-11-21(25)30-20/h6-12,14,19,29H,3-5,13H2,1-2H3/t19-,23-,24-/m0/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	11	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
Androgen Receptor (Homo sapiens (Human))	BDBM50303812 ((S)-1-(5-Chlorothiophen-2-yl)-1-((5aR,6S)-1-(4-flu...) Show SMILES C[C@](O)([C@H]1CCCC2=Cc3c(ncn3C[C@]12C)-c1ccc(F)cc1)c1ccc(Cl)s1 |r,t:7| Show InChI InChI=1S/C24H24ClFN2OS/c1-23-13-28-14-27-22(15-6-8-17(26)9-7-15)18(28)12-16(23)4-3-5-19(23)24(2,29)20-10-11-21(25)30-20/h6-12,14,19,29H,3-5,13H2,1-2H3/t19-,23-,24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Binding affinity to androgen 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))	BDBM50303812 ((S)-1-(5-Chlorothiophen-2-yl)-1-((5aR,6S)-1-(4-flu...) Show SMILES C[C@](O)([C@H]1CCCC2=Cc3c(ncn3C[C@]12C)-c1ccc(F)cc1)c1ccc(Cl)s1 |r,t:7| Show InChI InChI=1S/C24H24ClFN2OS/c1-23-13-28-14-27-22(15-6-8-17(26)9-7-15)18(28)12-16(23)4-3-5-19(23)24(2,29)20-10-11-21(25)30-20/h6-12,14,19,29H,3-5,13H2,1-2H3/t19-,23-,24-/m0/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	11	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))	BDBM50303812 ((S)-1-(5-Chlorothiophen-2-yl)-1-((5aR,6S)-1-(4-flu...) Show SMILES C[C@](O)([C@H]1CCCC2=Cc3c(ncn3C[C@]12C)-c1ccc(F)cc1)c1ccc(Cl)s1 |r,t:7| Show InChI InChI=1S/C24H24ClFN2OS/c1-23-13-28-14-27-22(15-6-8-17(26)9-7-15)18(28)12-16(23)4-3-5-19(23)24(2,29)20-10-11-21(25)30-20/h6-12,14,19,29H,3-5,13H2,1-2H3/t19-,23-,24-/m0/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	253	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transactivation of GAL-4 tagged glucocorticoid receptor ligand binding domain expressed in human HeLa cells assessed as NP1 activation by luciferase ...				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