BDBM50005896 2-Butyl-1,8-dihydroxy-anthraquinone::CHEMBL41504

SMILES: CCCCc1ccc2C(=O)c3cccc(O)c3C(=O)c2c1O

InChI Key: InChIKey=GWXUHLWQLHEPJZ-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 = 50005896   

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
Leukocyte elastase (Homo sapiens (Human))	BDBM50005896 (2-Butyl-1,8-dihydroxy-anthraquinone | CHEMBL41504) Show SMILES CCCCc1ccc2C(=O)c3cccc(O)c3C(=O)c2c1O Show InChI InChI=1S/C18H16O4/c1-2-3-5-10-8-9-12-15(16(10)20)18(22)14-11(17(12)21)6-4-7-13(14)19/h4,6-9,19-20H,2-3,5H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.40E+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
Cathepsin G (Homo sapiens (Human))	BDBM50005896 (2-Butyl-1,8-dihydroxy-anthraquinone | CHEMBL41504) Show SMILES CCCCc1ccc2C(=O)c3cccc(O)c3C(=O)c2c1O Show InChI InChI=1S/C18H16O4/c1-2-3-5-10-8-9-12-15(16(10)20)18(22)14-11(17(12)21)6-4-7-13(14)19/h4,6-9,19-20H,2-3,5H2,1H3	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	2.40E+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