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BDBM24799 (3S,4S)-3-hydroxy-2,2-dimethyl-4-(prop-2-en-1-ylamino)-2H,3H,4H,5H,10H-naphtho[2,3-b]pyran-5,10-dione::Pyranonaphthoquinone derivative, 38

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

InChI Key: InChIKey=HKIMEGFIYCHVJQ-GUYCJALGSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 24799   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM24799
PNG
((3S,4S)-3-hydroxy-2,2-dimethyl-4-(prop-2-en-1-ylam...)
Show SMILES CC1(C)OC2=C([C@H](NCC=C)[C@@H]1O)C(=O)c1ccccc1C2=O |r,c:4|
Show InChI InChI=1S/C18H19NO4/c1-4-9-19-13-12-14(20)10-7-5-6-8-11(10)15(21)16(12)23-18(2,3)17(13)22/h4-8,13,17,19,22H,1,9H2,2-3H3/t13-,17-/m0/s1
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n/an/a 186n/an/an/an/an/an/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
More data for this
Ligand-Target Pair