BDBM24807 (3S,4S)-4-(benzyloxy)-3-hydroxy-2,2-dimethyl-2H,3H,4H,5H,10H-naphtho[2,3-b]pyran-5,10-dione::Pyranonaphthoquinone derivative, 46

SMILES: CC1(C)OC2=C([C@H](OCc3ccccc3)[C@@H]1O)C(=O)c1ccccc1C2=O

InChI Key: InChIKey=RFAXVFOZRRTRTE-SFTDATJTSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 24807   

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
Indoleamine 2,3-dioxygenase (Homo sapiens (Human))	BDBM24807 ((3S,4S)-4-(benzyloxy)-3-hydroxy-2,2-dimethyl-2H,3H...) Show SMILES CC1(C)OC2=C([C@H](OCc3ccccc3)[C@@H]1O)C(=O)c1ccccc1C2=O |r,c:4| Show InChI InChI=1S/C22H20O5/c1-22(2)21(25)20(26-12-13-8-4-3-5-9-13)16-17(23)14-10-6-7-11-15(14)18(24)19(16)27-22/h3-11,20-21,25H,12H2,1-2H3/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College					Assay Description The IC50 inhibition assays were performed in a 96-well microtiter plate format using purified recombinant IDO, which was added to the substrate, L-tr...				J Med Chem 51: 1706-18 (2008) Article DOI: 10.1021/jm7014155 BindingDB Entry DOI: 10.7270/Q2VD6WSV
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