BDBM50114092 1-{2-[4-(2-Acetyl-4,5-dihydroxy-phenyl)-2,3-dimethyl-butyl]-4,5-dihydroxy-phenyl}-ethanone::CHEMBL89275

SMILES: C[C@@H](Cc1cc(O)c(O)cc1C(C)=O)[C@H](C)Cc1cc(O)c(O)cc1C(C)=O

InChI Key: InChIKey=KMYXXSBBABLDMV-TXEJJXNPSA-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 = 50114092   

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
12-Lipoxygenase (12-LOX) (Homo sapiens (Human))	BDBM50114092 (1-{2-[4-(2-Acetyl-4,5-dihydroxy-phenyl)-2,3-dimeth...) Show SMILES C[C@@H](Cc1cc(O)c(O)cc1C(C)=O)[C@H](C)Cc1cc(O)c(O)cc1C(C)=O Show InChI InChI=1S/C22H26O6/c1-11(5-15-7-19(25)21(27)9-17(15)13(3)23)12(2)6-16-8-20(26)22(28)10-18(16)14(4)24/h7-12,25-28H,5-6H2,1-4H3/t11-,12+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibitory activity against human platelet 12-lipoxygenase (12-HLO)				J Med Chem 45: 2659-61 (2002) BindingDB Entry DOI: 10.7270/Q2GT5NWN
					More data for this Ligand-Target Pair
Arachidonate 15-lipoxygenase (Homo sapiens (Human))	BDBM50114092 (1-{2-[4-(2-Acetyl-4,5-dihydroxy-phenyl)-2,3-dimeth...) Show SMILES C[C@@H](Cc1cc(O)c(O)cc1C(C)=O)[C@H](C)Cc1cc(O)c(O)cc1C(C)=O Show InChI InChI=1S/C22H26O6/c1-11(5-15-7-19(25)21(27)9-17(15)13(3)23)12(2)6-16-8-20(26)22(28)10-18(16)14(4)24/h7-12,25-28H,5-6H2,1-4H3/t11-,12+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibitory activity against human reticulocyte 15-lipoxygenase (15-HLO)				J Med Chem 45: 2659-61 (2002) BindingDB Entry DOI: 10.7270/Q2GT5NWN
					More data for this Ligand-Target Pair