BDBM50250921 CHEMBL518103::isaindigotone

SMILES: COc1cc(\C=C2/CCn3c2nc2ccccc2c3=O)cc(OC)c1O

InChI Key: InChIKey=UBCUTNIGHUVICE-UKTHLTGXSA-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 = 50250921   

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 5-lipoxygenase (Homo sapiens (Human))	BDBM50250921 (CHEMBL518103 | isaindigotone) Show SMILES COc1cc(\C=C2/CCn3c2nc2ccccc2c3=O)cc(OC)c1O Show InChI InChI=1S/C20H18N2O4/c1-25-16-10-12(11-17(26-2)18(16)23)9-13-7-8-22-19(13)21-15-6-4-3-5-14(15)20(22)24/h3-6,9-11,23H,7-8H2,1-2H3/b13-9+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Murcia Curated by ChEMBL					Assay Description Inhibition of 5LO-mediated LTB4 production in human neutrophils by RIA				J Nat Prod 64: 1297-300 (2001) BindingDB Entry DOI: 10.7270/Q2GT5MXP
					More data for this Ligand-Target Pair