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Patent code US9758505

Compile Data Set for Download or QSAR
Found 35 hits of Enzyme Inhibition Constant Data   
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))
BDBM339961
PNG
(5-(6-fluoro-1H-indol-3-yl)-N- methylpyridin-2-amin...)
Show SMILES CNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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n/an/a 290n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339928
PNG
(6-fluoro-3-(6-methylpyridin-3- yl)-1H-indole | US9...)
Show SMILES Cc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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n/an/a 370n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339940
PNG
(5-(6-fluoro-1H-indol-3-yl)- N,N-dimethylpyridin-2-...)
Show SMILES CN(C)c1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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n/an/a 380n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339957
PNG
(2-((5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)amino)...)
Show SMILES OCCNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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n/an/a 490n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339941
PNG
(4-(5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)morphol...)
Show SMILES Fc1ccc2c(c[nH]c2c1)-c1ccc(nc1)N1CCOCC1
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n/an/a 540n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339955
PNG
(N1-(5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)-N2,N2...)
Show SMILES CN(C)CCNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339929
PNG
(6-fluoro-3-(6-(piperidin-4- yloxy)pyridin-3-yl)-1H...)
Show SMILES Fc1ccc2c(c[nH]c2c1)-c1ccc(OC2CCNCC2)nc1
PDB

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n/an/a 560n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339953
PNG
(N-(3-((5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)ami...)
Show SMILES CS(=O)(=O)NCCCNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
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n/an/a 620n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339943
PNG
(2-amino-1-(4-(5-(6-fluoro-1H- indol-3-yl)pyridin-2...)
Show SMILES NCC(=O)N1CCN(CC1)c1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339950
PNG
(5-(6-fluoro-1H-indol-3-yl)-N- (1-(methylsulfonyl)p...)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339956
PNG
(N-(2-((5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)ami...)
Show SMILES CS(=O)(=O)NCCNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339942
PNG
(6-fluoro-3-(6-(4- methylpiperazin-1-yl)pyridin- 3-...)
Show SMILES CN1CCN(CC1)c1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339938
PNG
(6-fluoro-3-(6-methoxypyridin- 3-yl)-1H-indole | US...)
Show SMILES COc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339960
PNG
(2-((5-(6-fluoro-1H-indol-3- yl)pyridin-2- yl)amino...)
Show SMILES NC(=O)CNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339963
PNG
(6-fluoro-3-(pyridin-3-yl)-1H- indole | US9758505, ...)
Show SMILES Fc1ccc2c(c[nH]c2c1)-c1cccnc1
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339964
PNG
(6-fluoro-3-(2-methylpyridin-3- yl)-1H-indole | US9...)
Show SMILES Cc1ncccc1-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339948
PNG
(5-(6-fluoro-1H-indol-3-yl)-N- (piperidin-4-yl)pyri...)
Show SMILES Fc1ccc2c(c[nH]c2c1)-c1ccc(NC2CCNCC2)nc1
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339951
PNG
(N-(3-((5-(6-fluoro-1H-indol-3- yl)pyridin-2- yl)am...)
Show SMILES CC(=O)NCCCNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339945
PNG
(N-(1-(5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)pipe...)
Show SMILES CS(=O)(=O)NC1CCN(CC1)c1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339962
PNG
(N-(5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)acetami...)
Show SMILES CC(=O)Nc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339946
PNG
(5-(6-fluoro-1H-indol-3- yl)pyridin-2-amine | US975...)
Show SMILES Nc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339936
PNG
(6-fluoro-3-(6-((1- methylpiperidin-4- yl)oxy)pyrid...)
Show SMILES CN1CCC(CC1)Oc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339954
PNG
(5-(6-fluoro-1H-indol-3-yl)-N- (3-(methylsulfonyl)p...)
Show SMILES CS(=O)(=O)CCCNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339939
PNG
(5-(6-fluoro-1H-indol-3-yl)-N- (1-(methylsulfonyl)p...)
Show SMILES CS(=O)(=O)N1CCC(CC1)Oc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339958
PNG
(5-(6-fluoro-1H-indol-3-yl)-N- (2-(methylsulfonyl)e...)
Show SMILES CS(=O)(=O)CCNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339947
PNG
(5-(5,6-difluoro-1H-indol-3- yl)pyridin-2-amine | U...)
Show SMILES Nc1ccc(cn1)-c1c[nH]c2cc(F)c(F)cc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339959
PNG
(2-((5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)amino)...)
Show SMILES OC(=O)CNc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339944
PNG
(2-amino-N-(1-(5-(6-fluoro- 1H-indol-3-yl)pyridin-2...)
Show SMILES NCC(=O)NC1CCN(CC1)c1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339966
PNG
(5,6-difluoro-3-(pyridin-3-yl)- 1H-indole | US97585...)
Show SMILES Fc1cc2[nH]cc(-c3cccnc3)c2cc1F
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339967
PNG
(6-fluoro-3-(5-methylpyridin-3- yl)-1H-indole | US9...)
Show SMILES Cc1cncc(c1)-c1c[nH]c2cc(F)ccc12
PDB

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n/an/a 4.50E+3n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339949
PNG
(N-(1-ethylpiperidin-4-yl)-5-(6- fluoro-1H-indol-3-...)
Show SMILES CCN1CCC(CC1)Nc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339968
PNG
(3-(6-fluoro-1H-indol-3- yl)pyridine 1-oxide | US97...)
Show SMILES [O-][n+]1cccc(c1)-c1c[nH]c2cc(F)ccc12
PDB

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UniProtKB/SwissProt

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US Patent
n/an/a 1.10E+4n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339965
PNG
(6-fluoro-3-(4-methylpyridin-3- yl)-1H-indole | US9...)
Show SMILES Cc1ccncc1-c1c[nH]c2cc(F)ccc12
PDB

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n/an/a 1.30E+4n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339969
PNG
(1-(5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)imidazo...)
Show SMILES Fc1ccc2c(c[nH]c2c1)-c1ccc(nc1)N1CCNC1=O
PDB

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n/an/a 1.60E+4n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
Tryptophan 2,3-dioxygenase


(Homo sapiens (Human))
BDBM339937
PNG
(2-((5-(6-fluoro-1H-indol-3- yl)pyridin-2-yl)oxy)-N...)
Show SMILES CN(C)CCOc1ccc(cn1)-c1c[nH]c2cc(F)ccc12
PDB

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UniProtKB/SwissProt

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n/an/a 3.90E+4n/an/an/an/an/an/a



iTeos Therapeutics

US Patent


Assay Description
The compounds of formula I inhibit the enzymatic activity of human TDO2.To measure the TDO2 activity, the procedure described in Dolusic et al. J. Me...


US Patent US9758505 (2017)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%