BDBM50005884 2-Hexyl-1,8-dihydroxy-anthraquinone::CHEMBL41317

SMILES: CCCCCCc1ccc2C(=O)c3cccc(O)c3C(=O)c2c1O

InChI Key: InChIKey=SEMCWGFHMAHXMF-UHFFFAOYSA-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 = 50005884   

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
Cathepsin G (Homo sapiens (Human))	BDBM50005884 (2-Hexyl-1,8-dihydroxy-anthraquinone | CHEMBL41317) Show SMILES CCCCCCc1ccc2C(=O)c3cccc(O)c3C(=O)c2c1O Show InChI InChI=1S/C20H20O4/c1-2-3-4-5-7-12-10-11-14-17(18(12)22)20(24)16-13(19(14)23)8-6-9-15(16)21/h6,8-11,21-22H,2-5,7H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
School of Chemistry and Biochemistry Curated by ChEMBL					Assay Description Inhibition of Cathepsin G (CatG)				J Med Chem 35: 1597-605 (1992) BindingDB Entry DOI: 10.7270/Q2QN67D7
					More data for this Ligand-Target Pair
Leukocyte elastase (Homo sapiens (Human))	BDBM50005884 (2-Hexyl-1,8-dihydroxy-anthraquinone | CHEMBL41317) Show SMILES CCCCCCc1ccc2C(=O)c3cccc(O)c3C(=O)c2c1O Show InChI InChI=1S/C20H20O4/c1-2-3-4-5-7-12-10-11-14-17(18(12)22)20(24)16-13(19(14)23)8-6-9-15(16)21/h6,8-11,21-22H,2-5,7H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
School of Chemistry and Biochemistry Curated by ChEMBL					Assay Description In vitro inhibition of human leukocyte elastase.				J Med Chem 35: 1597-605 (1992) BindingDB Entry DOI: 10.7270/Q2QN67D7
					More data for this Ligand-Target Pair