BDBM50444816 CHEMBL3099219

SMILES: CC(C)(C)c1cc(C=NNC(=O)c2ccccc2O)c(O)c(c1)C(C)(C)C

InChI Key: InChIKey=XTKKQXQJBUOSMA-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 = 50444816   

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))	BDBM50444816 (CHEMBL3099219) Show SMILES CC(C)(C)c1cc(C=NNC(=O)c2ccccc2O)c(O)c(c1)C(C)(C)C |w:7.6| Show InChI InChI=1S/C22H28N2O3/c1-21(2,3)15-11-14(19(26)17(12-15)22(4,5)6)13-23-24-20(27)16-9-7-8-10-18(16)25/h7-13,25-26H,1-6H3,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of South Carolina Curated by ChEMBL					Assay Description Inhibition of 5-LOX (unknown origin) by ELISA				Bioorg Med Chem Lett 24: 317-24 (2013) Article DOI: 10.1016/j.bmcl.2013.11.015 BindingDB Entry DOI: 10.7270/Q2BK1DTP
					More data for this Ligand-Target Pair