BDBM50041802 1,8-dihydroxy-9(10H)-anthracenone::1,8-dihydroxy-9-anthrone::1,8-dihydroxyanthracen-9(10H)-one::1,8-dihydroxyanthrone::CHEMBL46469::US9182402, 15::anthralin::cid_2202::dithranol

SMILES: Oc1cccc2Cc3cccc(O)c3C(=O)c12

InChI Key: InChIKey=NUZWLKWWNNJHPT-UHFFFAOYSA-N

Data: 11 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 11 hits for monomerid = 50041802   

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
core protein (Hepatitis C virus)	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	UniProtKB/TrEMBL GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	>4.98E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q29Z939R
					More data for this Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G (Homo sapiens (Human))	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	25
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2HQ3XD6
					More data for this Ligand-Target Pair
Hepsin (Homo sapiens (Human))	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Fred Hutchinson Cancer Research Center US Patent					Assay Description To identify novel inhibitors of hepsin, the Chembridge DIVERSet 10,000 compound high-diversity library was screened using an assay based on the cleav...				US Patent US9182402 (2015) BindingDB Entry DOI: 10.7270/Q23F4NF7
					More data for this Ligand-Target Pair
Trypsin (Sus scrofa)	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Fred Hutchinson Cancer Research Center US Patent					Assay Description To identify novel inhibitors of hepsin, the Chembridge DIVERSet 10,000 compound high-diversity library was screened using an assay based on the cleav...				US Patent US9182402 (2015) BindingDB Entry DOI: 10.7270/Q23F4NF7
					More data for this Ligand-Target Pair
Thrombin (Bos taurus (Bovine))	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB UniProtKB/SwissProt GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Fred Hutchinson Cancer Research Center US Patent					Assay Description To identify novel inhibitors of hepsin, the Chembridge DIVERSet 10,000 compound high-diversity library was screened using an assay based on the cleav...				US Patent US9182402 (2015) BindingDB Entry DOI: 10.7270/Q23F4NF7
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Bos taurus)	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB Reactome pathway UniProtKB/TrEMBL B.MOAD GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Westfälische Wilhelms-Universität Münster Curated by ChEMBL					Assay Description 5-LO inhibitory activity was determined by inhibition of LTB4 biosynthesis in bovine polymorphonuclear leukocytes (PMNL)				J Med Chem 40: 3773-80 (1997) Article DOI: 10.1021/jm970292n BindingDB Entry DOI: 10.7270/Q20R9NJN
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universität Regensburg Curated by ChEMBL					Assay Description Inhibitory concentration against arachidonic acid 5-lipoxygenation				J Med Chem 37: 1660-9 (1994) Article DOI: 10.1021/jm00037a017 BindingDB Entry DOI: 10.7270/Q2H70DW9
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Bos taurus)	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB Reactome pathway UniProtKB/TrEMBL B.MOAD GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universität Regensburg Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in bovine polymorphonuclear leukocytes				J Med Chem 37: 1660-9 (1994) Article DOI: 10.1021/jm00037a017 BindingDB Entry DOI: 10.7270/Q2H70DW9
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Bos taurus)	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB Reactome pathway UniProtKB/TrEMBL B.MOAD GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universität Regensburg Curated by ChEMBL					Assay Description Inhibitory activity against 5-lipoxygenase (inhibition of 5-HETE and LTB4 biosynthesis) in bovine polymorphonuclear leukocytes (PMNL).				J Med Chem 36: 4099-107 (1994) Article DOI: 10.1021/jm00077a015 BindingDB Entry DOI: 10.7270/Q2G44PC2
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Bos taurus)	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB Reactome pathway UniProtKB/TrEMBL B.MOAD GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Westfälische Wilhelms-Universität Münster Curated by ChEMBL					Assay Description 5-LO inhibitory activity, measured by production of 5-hydroxyeicosatetraenoic acid (5-HETE) and leukotriene B4 (LTB4) in bovine polymorphonuclear leu...				J Med Chem 40: 2780-7 (1997) Article DOI: 10.1021/jm9701785 BindingDB Entry DOI: 10.7270/Q28C9VB4
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Bos taurus)	BDBM50041802 (1,8-dihydroxy-9(10H)-anthracenone | 1,8-dihydroxy-...) Show SMILES Oc1cccc2Cc3cccc(O)c3C(=O)c12 Show InChI InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2	PDB MMDB Reactome pathway UniProtKB/TrEMBL B.MOAD GoogleScholar	Purchase CHEBI CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universität Regensburg Curated by ChEMBL					Assay Description Tested for the inhibition of lipid peroxidation in bovine brain phospholipid liposomes				J Med Chem 36: 4099-107 (1994) Article DOI: 10.1021/jm00077a015 BindingDB Entry DOI: 10.7270/Q2G44PC2
					More data for this Ligand-Target Pair