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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Indoleamine 2,3-dioxygenase 1' and Ligand = 'BDBM50336434'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50336434
PNG
(1-(1H-Indol-2-yl)-2-pyridin-3-yl-ethanone | CHEMBL...)
Show SMILES O=C(Cc1cccnc1)c1cc2ccccc2[nH]1
Show InChI InChI=1S/C15H12N2O/c18-15(8-11-4-3-7-16-10-11)14-9-12-5-1-2-6-13(12)17-14/h1-7,9-10,17H,8H2
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MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
1.90E+5n/an/an/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Uncompetitive inhibition of histidine-tagged human recombinant IDO expressed in bacterial strain BL21 AI using L-Trptophan as substrate measured at 4...


Eur J Med Chem 46: 3058-65 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.049
BindingDB Entry DOI: 10.7270/Q2F19029
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50336434
PNG
(1-(1H-Indol-2-yl)-2-pyridin-3-yl-ethanone | CHEMBL...)
Show SMILES O=C(Cc1cccnc1)c1cc2ccccc2[nH]1
Show InChI InChI=1S/C15H12N2O/c18-15(8-11-4-3-7-16-10-11)14-9-12-5-1-2-6-13(12)17-14/h1-7,9-10,17H,8H2
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.50E+4n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human IDO activity by spectrophotometry


Bioorg Med Chem 19: 1550-61 (2011)


Article DOI: 10.1016/j.bmc.2010.12.032
BindingDB Entry DOI: 10.7270/Q27M087F
More data for this
Ligand-Target Pair