BDBM50246210 2-(3,4-dihydroxyphenyl)-4-(7-(3,4-dihydroxyphenyl)-2,4,6-trihydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)chroman-3,5,7-triol::CHEMBL455833::NSC-143099

SMILES: OC1Cc2c(O)cc(O)c(C3C(O)C(Oc4cc(O)cc(O)c34)c3ccc(O)c(O)c3)c2CC1c1ccc(O)c(O)c1

InChI Key: InChIKey=XMIJRXVCFAOTEG-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50246210   

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
Concanavalin-A (Canavalia ensiformis)	BDBM50246210 (2-(3,4-dihydroxyphenyl)-4-(7-(3,4-dihydroxyphenyl)...) Show SMILES OC1Cc2c(O)cc(O)c(C3C(O)C(Oc4cc(O)cc(O)c34)c3ccc(O)c(O)c3)c2CC1c1ccc(O)c(O)c1 Show InChI InChI=1S/C31H28O11/c32-14-7-24(39)28-26(8-14)42-31(13-2-4-19(34)23(38)6-13)30(41)29(28)27-17-9-15(12-1-3-18(33)22(37)5-12)20(35)10-16(17)21(36)11-25(27)40/h1-8,11,15,20,29-41H,9-10H2	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.79E+5	n/a	n/a	n/a	n/a	n/a	n/a
Georgia Southern University Curated by ChEMBL					Assay Description Inhibition of Canavalia ensiformis concanavalin A binding to yeast mannan by ELLA				Bioorg Med Chem Lett 18: 6573-5 (2008) Article DOI: 10.1016/j.bmcl.2008.09.095 BindingDB Entry DOI: 10.7270/Q2ZW1KRJ
					More data for this Ligand-Target Pair