Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 324.3 BDBM50290080

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Retinoic acid receptor alpha (Homo sapiens (Human))	BDBM50290080 (3-(3-tert-Butyl-4-hydroxy-phenyl)-2H-chromene-7-ca...) Show SMILES CC(C)(C)c1cc(ccc1O)C1=Cc2ccc(cc2OC1)C(O)=O |t:12| Show InChI InChI=1S/C20H20O4/c1-20(2,3)16-9-12(6-7-17(16)21)15-8-13-4-5-14(19(22)23)10-18(13)24-11-15/h4-10,21H,11H2,1-3H3,(H,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity towards Retinoic acid receptor alpha				Bioorg Med Chem Lett 7: 2289-2294 (1997) Article DOI: 10.1016/S0960-894X(97)00405-8 BindingDB Entry DOI: 10.7270/Q2HD7W4M
					More data for this Ligand-Target Pair
Retinoic acid receptor gamma (Homo sapiens (Human))	BDBM50290080 (3-(3-tert-Butyl-4-hydroxy-phenyl)-2H-chromene-7-ca...) Show SMILES CC(C)(C)c1cc(ccc1O)C1=Cc2ccc(cc2OC1)C(O)=O |t:12| Show InChI InChI=1S/C20H20O4/c1-20(2,3)16-9-12(6-7-17(16)21)15-8-13-4-5-14(19(22)23)10-18(13)24-11-15/h4-10,21H,11H2,1-3H3,(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity towards Retinoic acid receptor gamma				Bioorg Med Chem Lett 7: 2289-2294 (1997) Article DOI: 10.1016/S0960-894X(97)00405-8 BindingDB Entry DOI: 10.7270/Q2HD7W4M
					More data for this Ligand-Target Pair
Retinoic acid receptor beta (Homo sapiens (Human))	BDBM50290080 (3-(3-tert-Butyl-4-hydroxy-phenyl)-2H-chromene-7-ca...) Show SMILES CC(C)(C)c1cc(ccc1O)C1=Cc2ccc(cc2OC1)C(O)=O |t:12| Show InChI InChI=1S/C20H20O4/c1-20(2,3)16-9-12(6-7-17(16)21)15-8-13-4-5-14(19(22)23)10-18(13)24-11-15/h4-10,21H,11H2,1-3H3,(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity towards Retinoic acid receptor beta				Bioorg Med Chem Lett 7: 2289-2294 (1997) Article DOI: 10.1016/S0960-894X(97)00405-8 BindingDB Entry DOI: 10.7270/Q2HD7W4M
					More data for this Ligand-Target Pair