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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Indoleamine 2,3-dioxygenase 1' and Ligand = 'BDBM494768'   
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))
BDBM494768
PNG
(N-(4-fluorobicyclo[4.2.0]octa- 1(6),2,4-trien-7-yl...)
Show SMILES NC(=O)NCCNc1nonc1\C(NC1Cc2ccc(F)cc12)=N\O
Show InChI InChI=1S/C14H16FN7O3/c15-8-2-1-7-5-10(9(7)6-8)19-13(20-24)11-12(22-25-21-11)17-3-4-18-14(16)23/h1-2,6,10,24H,3-5H2,(H,17,22)(H,19,20)(H3,16,18,23)
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 41.5n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
HIS-tagged IDO1 protein was recombinantly expressed in Escherichia coli using ZYP5052 autoinduction media supplemented with 500 μM delta aminole...


US Patent US10988487 (2021)


BindingDB Entry DOI: 10.7270/Q25T3PKG
More data for this
Ligand-Target Pair