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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tryptophan 2,3-dioxygenase' and Ligand = 'BDBM50321320'   
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
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM50321320
PNG
(CHEMBL4168362)
Show SMILES CNC(=O)c1oncc1-c1ccccc1
Show InChI InChI=1S/C11H10N2O2/c1-12-11(14)10-9(7-13-15-10)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,14)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of recombinant human TDO2 assessed as decrease in conversion of L-tryptophan to N-formylkynurenine preincubated for 5 mins followed by 0.2...


ACS Med Chem Lett 9: 417-421 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00427
BindingDB Entry DOI: 10.7270/Q2M0481G
More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM50321320
PNG
(CHEMBL4168362)
Show SMILES CNC(=O)c1oncc1-c1ccccc1
Show InChI InChI=1S/C11H10N2O2/c1-12-11(14)10-9(7-13-15-10)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,14)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>2.50E+4n/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of TDO2 in human SW48 cells assessed as decrease in conversion of tryptophan to N-formylkynurenine after 30 mins by fluorescence assay


ACS Med Chem Lett 9: 417-421 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00427
BindingDB Entry DOI: 10.7270/Q2M0481G
More data for this
Ligand-Target Pair