BDBM50218851 CHEMBL88268::SR-14

SMILES: C=CCOc1cccc2c1C(=O)C=CC21Oc2cccc3cccc(O1)c23

InChI Key: InChIKey=MVVMBMCIEADNPB-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50218851   

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
Thioredoxin reductase 3 (Homo sapiens (Human))	BDBM50218851 (CHEMBL88268 | SR-14) Show SMILES C=CCOc1cccc2c1C(=O)C=CC21Oc2cccc3cccc(O1)c23 |c:13| Show InChI InChI=1S/C23H16O4/c1-2-14-25-18-9-5-8-16-22(18)17(24)12-13-23(16)26-19-10-3-6-15-7-4-11-20(27-23)21(15)19/h2-13H,1,14H2	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Pittsburgh Curated by ChEMBL					Assay Description Inhibition of thioredoxin reductase				Bioorg Med Chem Lett 11: 2637-41 (2001) BindingDB Entry DOI: 10.7270/Q22R3TTN
					More data for this Ligand-Target Pair
Thioredoxin reductase 3 (Homo sapiens (Human))	BDBM50218851 (CHEMBL88268 | SR-14) Show SMILES C=CCOc1cccc2c1C(=O)C=CC21Oc2cccc3cccc(O1)c23 |c:13| Show InChI InChI=1S/C23H16O4/c1-2-14-25-18-9-5-8-16-22(18)17(24)12-13-23(16)26-19-10-3-6-15-7-4-11-20(27-23)21(15)19/h2-13H,1,14H2	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.32E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Pittsburgh Curated by ChEMBL					Assay Description Inhibition of thioredoxin-1/thioredoxin reductase system				Bioorg Med Chem Lett 11: 2637-41 (2001) BindingDB Entry DOI: 10.7270/Q22R3TTN
					More data for this Ligand-Target Pair