BDBM50065995 4-[(2S,3R)-4-(3,4-Dimethoxy-phenyl)-2,3-dimethyl-butyl]-benzene-1,2-diol::4-[4-(3,4-Dimethoxy-phenyl)-2,3-dimethyl-butyl]-benzene-1,2-diol::CHEMBL91531

SMILES: COc1ccc(C[C@@H](C)[C@@H](C)Cc2ccc(O)c(O)c2)cc1OC

InChI Key: InChIKey=ICZUIJGVBIFLAX-UONOGXRCSA-N

Data: 3 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 3 hits for monomerid = 50065995   

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
Arachidonate 15-lipoxygenase (Homo sapiens (Human))	BDBM50065995 (4-[(2S,3R)-4-(3,4-Dimethoxy-phenyl)-2,3-dimethyl-b...) Show SMILES COc1ccc(C[C@@H](C)[C@@H](C)Cc2ccc(O)c(O)c2)cc1OC Show InChI InChI=1S/C20H26O4/c1-13(9-15-5-7-17(21)18(22)11-15)14(2)10-16-6-8-19(23-3)20(12-16)24-4/h5-8,11-14,21-22H,9-10H2,1-4H3/t13-,14+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	580	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
Lipoxygenase-1 (Glycine max (soybean))	BDBM50065995 (4-[(2S,3R)-4-(3,4-Dimethoxy-phenyl)-2,3-dimethyl-b...) Show SMILES COc1ccc(C[C@@H](C)[C@@H](C)Cc2ccc(O)c(O)c2)cc1OC Show InChI InChI=1S/C20H26O4/c1-13(9-15-5-7-17(21)18(22)11-15)14(2)10-16-6-8-19(23-3)20(12-16)24-4/h5-8,11-14,21-22H,9-10H2,1-4H3/t13-,14+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibitory activity against soybean 1-lipoxygenase (SLO)				J Med Chem 45: 2659-61 (2002) BindingDB Entry DOI: 10.7270/Q2GT5NWN
					More data for this Ligand-Target Pair
12-Lipoxygenase (12-LOX) (Homo sapiens (Human))	BDBM50065995 (4-[(2S,3R)-4-(3,4-Dimethoxy-phenyl)-2,3-dimethyl-b...) Show SMILES COc1ccc(C[C@@H](C)[C@@H](C)Cc2ccc(O)c(O)c2)cc1OC Show InChI InChI=1S/C20H26O4/c1-13(9-15-5-7-17(21)18(22)11-15)14(2)10-16-6-8-19(23-3)20(12-16)24-4/h5-8,11-14,21-22H,9-10H2,1-4H3/t13-,14+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.20E+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