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PubMed code 28667875

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
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM36371
PNG
(5-(1H-indol-3-ylmethyl)-3-methyl-2-thioxo-4-Imidaz...)
Show SMILES CN1C(=S)NC(Cc2c[nH]c3ccccc23)C1=O
Show InChI InChI=1S/C13H13N3OS/c1-16-12(17)11(15-13(16)18)6-8-7-14-10-5-3-2-4-9(8)10/h2-5,7,11,14H,6H2,1H3,(H,15,18)
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1.14E+4n/an/an/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IDO1 (unknown origin)


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50241727
PNG
((S)-2-amino-3-(1-methyl-1H-indol-3-yl)propanoic ac...)
Show SMILES Cn1cc(C[C@H](N)C(O)=O)c2ccccc12 |r|
Show InChI InChI=1S/C12H14N2O2/c1-14-7-8(6-10(13)12(15)16)9-4-2-3-5-11(9)14/h2-5,7,10H,6,13H2,1H3,(H,15,16)/t10-/m0/s1
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PubMed
3.00E+4n/an/an/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IDO1 (unknown origin)


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50126144
PNG
(CHEMBL3629569 | US10155972, Compound NewLink 1 | U...)
Show SMILES OC(CC1c2ccccc2-c2cncn12)C1CCCCC1
Show InChI InChI=1S/C18H22N2O/c21-18(13-6-2-1-3-7-13)10-16-14-8-4-5-9-15(14)17-11-19-12-20(16)17/h4-5,8-9,11-13,16,18,21H,1-3,6-7,10H2
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n/an/a 410n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456430
PNG
(CHEMBL4205135)
Show SMILES Clc1ccc(Cn2c3cc(Cl)ccc3oc2=O)cc1
Show InChI InChI=1S/C14H9Cl2NO2/c15-10-3-1-9(2-4-10)8-17-12-7-11(16)5-6-13(12)19-14(17)18/h1-7H,8H2
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n/an/a 6.08E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456412
PNG
(CHEMBL4204527)
Show SMILES Fc1ccc(CC(=O)n2c3cc(Cl)ccc3oc2=O)cc1
Show InChI InChI=1S/C15H9ClFNO3/c16-10-3-6-13-12(8-10)18(15(20)21-13)14(19)7-9-1-4-11(17)5-2-9/h1-6,8H,7H2
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n/an/a 6.40E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456416
PNG
(CHEMBL4204643)
Show SMILES Fc1cccc(Cn2c3cc(Cl)ccc3oc2=O)c1
Show InChI InChI=1S/C14H9ClFNO2/c15-10-4-5-13-12(7-10)17(14(18)19-13)8-9-2-1-3-11(16)6-9/h1-7H,8H2
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n/an/a 9.75E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456420
PNG
(CHEMBL4216081)
Show SMILES OC(Cn1c2cc(Cl)ccc2oc1=O)c1ccc(F)cc1
Show InChI InChI=1S/C15H11ClFNO3/c16-10-3-6-14-12(7-10)18(15(20)21-14)8-13(19)9-1-4-11(17)5-2-9/h1-7,13,19H,8H2
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n/an/a 1.02E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456428
PNG
(CHEMBL4209018)
Show SMILES COc1cccc(CNC(=O)n2c3cc(Cl)ccc3oc2=O)c1
Show InChI InChI=1S/C16H13ClN2O4/c1-22-12-4-2-3-10(7-12)9-18-15(20)19-13-8-11(17)5-6-14(13)23-16(19)21/h2-8H,9H2,1H3,(H,18,20)
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n/an/a 1.46E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456427
PNG
(CHEMBL4208580)
Show SMILES Clc1ccc2oc(=O)n(CCc3ccccc3)c2c1
Show InChI InChI=1S/C15H12ClNO2/c16-12-6-7-14-13(10-12)17(15(18)19-14)9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2
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n/an/a 1.79E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456423
PNG
(CHEMBL4205040)
Show SMILES Fc1ccc(cc1)C(=O)Cn1c2cc(Cl)ccc2oc1=O
Show InChI InChI=1S/C15H9ClFNO3/c16-10-3-6-14-12(7-10)18(15(20)21-14)8-13(19)9-1-4-11(17)5-2-9/h1-7H,8H2
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n/an/a 2.07E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456405
PNG
(CHEMBL4217799)
Show SMILES Nc1nc2ccccc2n1C(=O)Cc1ccc(F)cc1
Show InChI InChI=1S/C15H12FN3O/c16-11-7-5-10(6-8-11)9-14(20)19-13-4-2-1-3-12(13)18-15(19)17/h1-8H,9H2,(H2,17,18)
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n/an/a 2.27E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456422
PNG
(CHEMBL4204542)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cc(Cl)ccc2oc1=O
Show InChI InChI=1S/C15H9Cl2NO3/c16-10-3-1-9(2-4-10)13(19)8-18-12-7-11(17)5-6-14(12)21-15(18)20/h1-7H,8H2
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n/an/a 2.49E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456415
PNG
(CHEMBL4214555)
Show SMILES Fc1cccc(Cn2c3cc(F)ccc3oc2=O)c1
Show InChI InChI=1S/C14H9F2NO2/c15-10-3-1-2-9(6-10)8-17-12-7-11(16)4-5-13(12)19-14(17)18/h1-7H,8H2
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n/an/a 2.85E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456418
PNG
(CHEMBL1557295)
Show SMILES Fc1cccc(Cn2c3ccccc3oc2=O)c1
Show InChI InChI=1S/C14H10FNO2/c15-11-5-3-4-10(8-11)9-16-12-6-1-2-7-13(12)18-14(16)17/h1-8H,9H2
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n/an/a 3.08E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456411
PNG
(CHEMBL4203649)
Show SMILES COc1ccc(CNC(=O)n2c3ccccc3oc2=O)cc1
Show InChI InChI=1S/C16H14N2O4/c1-21-12-8-6-11(7-9-12)10-17-15(19)18-13-4-2-3-5-14(13)22-16(18)20/h2-9H,10H2,1H3,(H,17,19)
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n/an/a 3.18E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456417
PNG
(CHEMBL4213517)
Show SMILES Clc1ccc(Cn2c3ccccc3oc2=O)cc1
Show InChI InChI=1S/C14H10ClNO2/c15-11-7-5-10(6-8-11)9-16-12-3-1-2-4-13(12)18-14(16)17/h1-8H,9H2
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n/an/a 3.50E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456408
PNG
(CHEMBL4217258)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2ccccc2oc1=O
Show InChI InChI=1S/C15H10ClNO3/c16-11-7-5-10(6-8-11)13(18)9-17-12-3-1-2-4-14(12)20-15(17)19/h1-8H,9H2
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n/an/a 3.86E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456433
PNG
(CHEMBL4216727)
Show SMILES Clc1cccc(c1)C(=O)Cn1c2ccccc2oc1=O
Show InChI InChI=1S/C15H10ClNO3/c16-11-5-3-4-10(8-11)13(18)9-17-12-6-1-2-7-14(12)20-15(17)19/h1-8H,9H2
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n/an/a 4.93E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456404
PNG
(CHEMBL4208059)
Show SMILES OC(Cn1c2ccccc2oc1=O)c1ccc(F)cc1
Show InChI InChI=1S/C15H12FNO3/c16-11-7-5-10(6-8-11)13(18)9-17-12-3-1-2-4-14(12)20-15(17)19/h1-8,13,18H,9H2
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n/an/a 4.93E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456432
PNG
(CHEMBL4204366)
Show SMILES OC(Cn1c2ccccc2oc1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H12ClNO3/c16-11-7-5-10(6-8-11)13(18)9-17-12-3-1-2-4-14(12)20-15(17)19/h1-8,13,18H,9H2
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n/an/a 5.08E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456424
PNG
(CHEMBL4212289)
Show SMILES Fc1ccc(cc1)C(=O)Cn1c2ccccc2oc1=O
Show InChI InChI=1S/C15H10FNO3/c16-11-7-5-10(6-8-11)13(18)9-17-12-3-1-2-4-14(12)20-15(17)19/h1-8H,9H2
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n/an/a 5.31E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456419
PNG
(CHEMBL4209170)
Show SMILES OC(Cn1c2cc(Cl)ccc2oc1=O)c1cccc(Cl)c1
Show InChI InChI=1S/C15H11Cl2NO3/c16-10-3-1-2-9(6-10)13(19)8-18-12-7-11(17)4-5-14(12)21-15(18)20/h1-7,13,19H,8H2
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n/an/a 6.09E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456426
PNG
(CHEMBL4205684)
Show SMILES OC(Cn1c2cc(Cl)ccc2oc1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H11Cl2NO3/c16-10-3-1-9(2-4-10)13(19)8-18-12-7-11(17)5-6-14(12)21-15(18)20/h1-7,13,19H,8H2
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n/an/a 6.27E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456421
PNG
(CHEMBL4209417)
Show SMILES Clc1cccc(c1)C(=O)Cn1c2cc(Cl)ccc2oc1=O
Show InChI InChI=1S/C15H9Cl2NO3/c16-10-3-1-2-9(6-10)13(19)8-18-12-7-11(17)4-5-14(12)21-15(18)20/h1-7H,8H2
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n/an/a 7.66E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50241727
PNG
((S)-2-amino-3-(1-methyl-1H-indol-3-yl)propanoic ac...)
Show SMILES Cn1cc(C[C@H](N)C(O)=O)c2ccccc12 |r|
Show InChI InChI=1S/C12H14N2O2/c1-14-7-8(6-10(13)12(15)16)9-4-2-3-5-11(9)14/h2-5,7,10H,6,13H2,1H3,(H,15,16)/t10-/m0/s1
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Article
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n/an/a 7.73E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456407
PNG
(CHEMBL4212295)
Show SMILES OC(Cn1c2ccccc2oc1=O)c1cccc(Cl)c1
Show InChI InChI=1S/C15H12ClNO3/c16-11-5-3-4-10(8-11)13(18)9-17-12-6-1-2-7-14(12)20-15(17)19/h1-8,13,18H,9H2
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n/an/a 8.06E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456414
PNG
(CHEMBL4210797)
Show SMILES Fc1ccc2oc(=O)n(Cc3ccc(Cl)cc3)c2c1
Show InChI InChI=1S/C14H9ClFNO2/c15-10-3-1-9(2-4-10)8-17-12-7-11(16)5-6-13(12)19-14(17)18/h1-7H,8H2
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n/an/a 8.08E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456429
PNG
(CHEMBL4216191)
Show SMILES O=C(c1ccccc1)n1c2ccccc2oc1=O
Show InChI InChI=1S/C14H9NO3/c16-13(10-6-2-1-3-7-10)15-11-8-4-5-9-12(11)18-14(15)17/h1-9H
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n/an/a 9.05E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456403
PNG
(CHEMBL4213252)
Show SMILES [O-][N+](=O)c1ccc2oc(=O)n(Cc3ccc(Cl)cc3)c2c1
Show InChI InChI=1S/C14H9ClN2O4/c15-10-3-1-9(2-4-10)8-16-12-7-11(17(19)20)5-6-13(12)21-14(16)18/h1-7H,8H2
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n/an/a 9.94E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456425
PNG
(CHEMBL4208319)
Show SMILES [O-][N+](=O)c1ccc2oc(=O)n(Cc3cccc(F)c3)c2c1
Show InChI InChI=1S/C14H9FN2O4/c15-10-3-1-2-9(6-10)8-16-12-7-11(17(19)20)4-5-13(12)21-14(16)18/h1-7H,8H2
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n/an/a 9.98E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456409
PNG
(CHEMBL4205092)
Show SMILES OC(Cn1c2ccccc2[nH]c1=O)c1ccc(F)cc1
Show InChI InChI=1S/C15H13FN2O2/c16-11-7-5-10(6-8-11)14(19)9-18-13-4-2-1-3-12(13)17-15(18)20/h1-8,14,19H,9H2,(H,17,20)
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n/an/a 9.99E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456431
PNG
(CHEMBL1444923)
Show SMILES O=c1oc2ccccc2n1CCc1ccccc1
Show InChI InChI=1S/C15H13NO2/c17-15-16(11-10-12-6-2-1-3-7-12)13-8-4-5-9-14(13)18-15/h1-9H,10-11H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456406
PNG
(CHEMBL4203984)
Show SMILES Nc1ccc2oc(=O)n(Cc3cccc(F)c3)c2c1
Show InChI InChI=1S/C14H11FN2O2/c15-10-3-1-2-9(6-10)8-17-12-7-11(16)4-5-13(12)19-14(17)18/h1-7H,8,16H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456410
PNG
(CHEMBL4207877)
Show SMILES COc1ccc(NC(=O)n2c3cc(Cl)ccc3oc2=O)cc1
Show InChI InChI=1S/C15H11ClN2O4/c1-21-11-5-3-10(4-6-11)17-14(19)18-12-8-9(16)2-7-13(12)22-15(18)20/h2-8H,1H3,(H,17,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50456413
PNG
(CHEMBL4208865)
Show SMILES Fc1ccc(CC(=O)n2c3ccccc3oc2=O)cc1
Show InChI InChI=1S/C15H10FNO3/c16-11-7-5-10(6-8-11)9-14(18)17-12-3-1-2-4-13(12)20-15(17)19/h1-8H,9H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of IFNgamma-induced IDO1 in human HeLa cells using L-tryptophan as substrate after 24 hrs


Eur J Med Chem 138: 199-211 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.039
BindingDB Entry DOI: 10.7270/Q2C25012
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%