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Compile Data Set for Download or QSAR

Found 135 hits of ki for UniProtKB: P14902   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50300305
PNG
(4-Amino-N-(3-chloro-4-fluorophenyl)-N'-hydroxy-1,2...)
Show SMILES Nc1nonc1C(NO)=Nc1ccc(F)c(Cl)c1
Show InChI InChI=1S/C9H7ClFN5O2/c10-5-3-4(1-2-6(5)11)13-9(14-17)7-8(12)16-18-15-7/h1-3,17H,(H2,12,16)(H,13,14)
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22n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203284
PNG
(CHEMBL3918741)
Show SMILES Brc1ccc(cc1)-c1c(C#N)c(=O)[nH]c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C14H7BrN4O3/c15-7-3-1-6(2-4-7)9-8(5-16)12(20)17-11-10(9)13(21)19-14(22)18-11/h1-4H,(H3,17,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203273
PNG
(CHEMBL3927664)
Show SMILES Fc1ccc(cc1)-c1c(C#N)c(=O)[nH]c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C14H7FN4O3/c15-7-3-1-6(2-4-7)9-8(5-16)12(20)17-11-10(9)13(21)19-14(22)18-11/h1-4H,(H3,17,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203260
PNG
(CHEMBL3974564)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(N)c3C(c12)c1ccc(F)c(Cl)c1
Show InChI InChI=1S/C14H11ClFN5O/c1-5-9-10(6-2-3-8(16)7(15)4-6)11-12(17)19-21-14(11)22-13(9)20-18-5/h2-4,10H,1H3,(H,18,20)(H3,17,19,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203269
PNG
(CHEMBL3913434)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1ccc(F)c(Cl)c1
Show InChI InChI=1S/C15H12ClFN4O/c1-6-11-13(8-3-4-10(17)9(16)5-8)12-7(2)19-21-15(12)22-14(11)20-18-6/h3-5,13H,1-2H3,(H,18,20)(H,19,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203278
PNG
(CHEMBL3986582)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1cccc(F)c1
Show InChI InChI=1S/C15H13FN4O/c1-7-11-13(9-4-3-5-10(16)6-9)12-8(2)18-20-15(12)21-14(11)19-17-7/h3-6,13H,1-2H3,(H,17,19)(H,18,20)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203250
PNG
(CHEMBL3941951)
Show SMILES NC1=C(C#N)C(c2ccc(F)cc2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H10FN5O2/c15-7-3-1-6(2-4-7)9-8(5-16)11(17)18-12-10(9)13(21)20-14(22)19-12/h1-4,9H,17H2,(H3,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203251
PNG
(CHEMBL3909806)
Show SMILES NC1=C(C#N)C(c2ccc(F)c(Cl)c2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H9ClFN5O2/c15-7-3-5(1-2-8(7)16)9-6(4-17)11(18)19-12-10(9)13(22)21-14(23)20-12/h1-3,9H,18H2,(H3,19,20,21,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203252
PNG
(CHEMBL3890673)
Show SMILES Fc1ccc(cc1F)-c1c(C#N)c(=O)[nH]c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C14H6F2N4O3/c15-7-2-1-5(3-8(7)16)9-6(4-17)12(21)18-11-10(9)13(22)20-14(23)19-11/h1-3H,(H3,18,19,20,21,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203253
PNG
(CHEMBL3960322)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H11ClN4O3/c1-6-9-10(7-2-4-8(16)5-3-7)11-12(21)17-15(22)18-13(11)23-14(9)20-19-6/h2-5,10H,1H3,(H,19,20)(H2,17,18,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203254
PNG
(CHEMBL3949167)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1ccccc1F
Show InChI InChI=1S/C15H13FN4O/c1-7-11-13(9-5-3-4-6-10(9)16)12-8(2)18-20-15(12)21-14(11)19-17-7/h3-6,13H,1-2H3,(H,17,19)(H,18,20)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203247
PNG
(CHEMBL3912388)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H12Cl2N4O/c1-6-11-13(8-3-4-9(16)10(17)5-8)12-7(2)19-21-15(12)22-14(11)20-18-6/h3-5,13H,1-2H3,(H,18,20)(H,19,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203261
PNG
(CHEMBL3899644)
Show SMILES Clc1ccc(cc1)-c1c(C#N)c(=O)[nH]c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C14H7ClN4O3/c15-7-3-1-6(2-4-7)9-8(5-16)12(20)17-11-10(9)13(21)19-14(22)18-11/h1-4H,(H3,17,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203262
PNG
(CHEMBL3931346)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H13ClN4O/c1-7-11-13(9-3-5-10(16)6-4-9)12-8(2)18-20-15(12)21-14(11)19-17-7/h3-6,13H,1-2H3,(H,17,19)(H,18,20)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203264
PNG
(CHEMBL3909309)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1cccc(F)c1
Show InChI InChI=1S/C15H11FN4O3/c1-6-9-10(7-3-2-4-8(16)5-7)11-12(21)17-15(22)18-13(11)23-14(9)20-19-6/h2-5,10H,1H3,(H,19,20)(H2,17,18,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203266
PNG
(CHEMBL3918239)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1ccc(F)cc1
Show InChI InChI=1S/C15H11FN4O3/c1-6-9-10(7-2-4-8(16)5-3-7)11-12(21)17-15(22)18-13(11)23-14(9)20-19-6/h2-5,10H,1H3,(H,19,20)(H2,17,18,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203249
PNG
(CHEMBL3945146)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(N)c3C(c12)c1ccc(F)c(F)c1
Show InChI InChI=1S/C14H11F2N5O/c1-5-9-10(6-2-3-7(15)8(16)4-6)11-12(17)19-21-14(11)22-13(9)20-18-5/h2-4,10H,1H3,(H,18,20)(H3,17,19,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203256
PNG
(CHEMBL3936225)
Show SMILES COc1ccc(cc1O)C1c2c(C)n[nH]c2Oc2[nH]nc(N)c12
Show InChI InChI=1S/C15H15N5O3/c1-6-10-11(7-3-4-9(22-2)8(21)5-7)12-13(16)18-20-15(12)23-14(10)19-17-6/h3-5,11,21H,1-2H3,(H,17,19)(H3,16,18,20)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203259
PNG
(CHEMBL3900740)
Show SMILES Fc1cccc(c1)-c1c(C#N)c(=O)[nH]c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C14H7FN4O3/c15-7-3-1-2-6(4-7)9-8(5-16)12(20)17-11-10(9)13(21)19-14(22)18-11/h1-4H,(H3,17,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203267
PNG
(CHEMBL3957792)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1cccc(Cl)c1
Show InChI InChI=1S/C15H13ClN4O/c1-7-11-13(9-4-3-5-10(16)6-9)12-8(2)18-20-15(12)21-14(11)19-17-7/h3-6,13H,1-2H3,(H,17,19)(H,18,20)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203282
PNG
(CHEMBL3915008)
Show SMILES NC1=C(C#N)C(c2cccc(F)c2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H10FN5O2/c15-7-3-1-2-6(4-7)9-8(5-16)11(17)18-12-10(9)13(21)20-14(22)19-12/h1-4,9H,17H2,(H3,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203270
PNG
(CHEMBL3904973)
Show SMILES NC1=C(C#N)C(c2ccc(Cl)cc2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H10ClN5O2/c15-7-3-1-6(2-4-7)9-8(5-16)11(17)18-12-10(9)13(21)20-14(22)19-12/h1-4,9H,17H2,(H3,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203258
PNG
(CHEMBL3957215)
Show SMILES NC1=C(C#N)C(c2ccc(F)c(F)c2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H9F2N5O2/c15-7-2-1-5(3-8(7)16)9-6(4-17)11(18)19-12-10(9)13(22)21-14(23)20-12/h1-3,9H,18H2,(H3,19,20,21,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203283
PNG
(CHEMBL3985889)
Show SMILES NC1=C(C#N)C(c2ccc(Cl)c(Cl)c2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H9Cl2N5O2/c15-7-2-1-5(3-8(7)16)9-6(4-17)11(18)19-12-10(9)13(22)21-14(23)20-12/h1-3,9H,18H2,(H3,19,20,21,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203281
PNG
(CHEMBL3971895)
Show SMILES Clc1cccc(c1)-c1c(C#N)c(=O)[nH]c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C14H7ClN4O3/c15-7-3-1-2-6(4-7)9-8(5-16)12(20)17-11-10(9)13(21)19-14(22)18-11/h1-4H,(H3,17,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203289
PNG
(CHEMBL3903361)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1ccc(Br)cc1
Show InChI InChI=1S/C15H13BrN4O/c1-7-11-13(9-3-5-10(16)6-4-9)12-8(2)18-20-15(12)21-14(11)19-17-7/h3-6,13H,1-2H3,(H,17,19)(H,18,20)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203274
PNG
(CHEMBL3945545)
Show SMILES Clc1ccc(cc1Cl)-c1c(C#N)c(=O)[nH]c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C14H6Cl2N4O3/c15-7-2-1-5(3-8(7)16)9-6(4-17)12(21)18-11-10(9)13(22)20-14(23)19-11/h1-3H,(H3,18,19,20,21,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203285
PNG
(CHEMBL3890191)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1cccc(Cl)c1
Show InChI InChI=1S/C15H11ClN4O3/c1-6-9-10(7-3-2-4-8(16)5-7)11-12(21)17-15(22)18-13(11)23-14(9)20-19-6/h2-5,10H,1H3,(H,19,20)(H2,17,18,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203286
PNG
(CHEMBL3891251)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1ccc(Br)cc1
Show InChI InChI=1S/C15H11BrN4O3/c1-6-9-10(7-2-4-8(16)5-3-7)11-12(21)17-15(22)18-13(11)23-14(9)20-19-6/h2-5,10H,1H3,(H,19,20)(H2,17,18,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203276
PNG
(CHEMBL3960467)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H10Cl2N4O3/c1-5-9-10(6-2-3-7(16)8(17)4-6)11-12(22)18-15(23)19-13(11)24-14(9)21-20-5/h2-4,10H,1H3,(H,20,21)(H2,18,19,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203268
PNG
(CHEMBL3909480)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1ccc(F)c(Cl)c1
Show InChI InChI=1S/C15H10ClFN4O3/c1-5-9-10(6-2-3-8(17)7(16)4-6)11-12(22)18-15(23)19-13(11)24-14(9)21-20-5/h2-4,10H,1H3,(H,20,21)(H2,18,19,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203248
PNG
(CHEMBL3930308)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1ccc(F)cc1
Show InChI InChI=1S/C15H13FN4O/c1-7-11-13(9-3-5-10(16)6-4-9)12-8(2)18-20-15(12)21-14(11)19-17-7/h3-6,13H,1-2H3,(H,17,19)(H,18,20)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203279
PNG
(CHEMBL3940383)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1ccc(F)c(F)c1
Show InChI InChI=1S/C15H12F2N4O/c1-6-11-13(8-3-4-9(16)10(17)5-8)12-7(2)19-21-15(12)22-14(11)20-18-6/h3-5,13H,1-2H3,(H,18,20)(H,19,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203287
PNG
(CHEMBL3983266)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(N)c3C(c12)c1ccc(F)cc1
Show InChI InChI=1S/C14H12FN5O/c1-6-9-10(7-2-4-8(15)5-3-7)11-12(16)18-20-14(11)21-13(9)19-17-6/h2-5,10H,1H3,(H,17,19)(H3,16,18,20)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203280
PNG
(CHEMBL3966057)
Show SMILES Nc1n[nH]c2Oc3[nH]nc(N)c3C(c12)c1ccc(F)c(F)c1
Show InChI InChI=1S/C13H10F2N6O/c14-5-2-1-4(3-6(5)15)7-8-10(16)18-20-12(8)22-13-9(7)11(17)19-21-13/h1-3,7H,(H3,16,18,20)(H3,17,19,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203263
PNG
(CHEMBL3927265)
Show SMILES Nc1n[nH]c2Oc3[nH]nc(N)c3C(c12)c1ccc(F)c(Cl)c1
Show InChI InChI=1S/C13H10ClFN6O/c14-5-3-4(1-2-6(5)15)7-8-10(16)18-20-12(8)22-13-9(7)11(17)19-21-13/h1-3,7H,(H3,16,18,20)(H3,17,19,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203255
PNG
(CHEMBL3913975)
Show SMILES NC1=C(C#N)C(c2cccc(Cl)c2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H10ClN5O2/c15-7-3-1-2-6(4-7)9-8(5-16)11(17)18-12-10(9)13(21)20-14(22)19-12/h1-4,9H,17H2,(H3,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203288
PNG
(CHEMBL3979528)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1ccccc1
Show InChI InChI=1S/C15H12N4O3/c1-7-9-10(8-5-3-2-4-6-8)11-12(20)16-15(21)17-13(11)22-14(9)19-18-7/h2-6,10H,1H3,(H,18,19)(H2,16,17,20,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203257
PNG
(CHEMBL3973927)
Show SMILES NC1=C(C#N)C(c2ccccc2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H11N5O2/c15-6-8-9(7-4-2-1-3-5-7)10-12(17-11(8)16)18-14(21)19-13(10)20/h1-5,9H,16H2,(H3,17,18,19,20,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203277
PNG
(CHEMBL3963472)
Show SMILES Cc1n[nH]c2Oc3[nH]nc(C)c3C(c12)c1ccccc1
Show InChI InChI=1S/C15H14N4O/c1-8-11-13(10-6-4-3-5-7-10)12-9(2)17-19-15(12)20-14(11)18-16-8/h3-7,13H,1-2H3,(H,16,18)(H,17,19)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203265
PNG
(CHEMBL3917645)
Show SMILES Fc1ccc(cc1Cl)-c1c(C#N)c(=O)[nH]c2[nH]c(=O)[nH]c(=O)c12
Show InChI InChI=1S/C14H6ClFN4O3/c15-7-3-5(1-2-8(7)16)9-6(4-17)12(21)18-11-10(9)13(22)20-14(23)19-11/h1-3H,(H3,18,19,20,21,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203271
PNG
(CHEMBL3932970)
Show SMILES NC1=C(C#N)C(c2ccc(Br)cc2)c2c(N1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C14H10BrN5O2/c15-7-3-1-6(2-4-7)9-8(5-16)11(17)18-12-10(9)13(21)20-14(22)19-12/h1-4,9H,17H2,(H3,18,19,20,21,22)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203272
PNG
(CHEMBL3979980)
Show SMILES O=c1[nH]c2[nH]c(=O)c(C#N)c(-c3ccccc3)c2c(=O)[nH]1
Show InChI InChI=1S/C14H8N4O3/c15-6-8-9(7-4-2-1-3-5-7)10-11(16-12(8)19)17-14(21)18-13(10)20/h1-5H,(H3,16,17,18,19,20,21)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50203275
PNG
(CHEMBL3971417)
Show SMILES Cc1n[nH]c2Oc3[nH]c(=O)[nH]c(=O)c3C(c12)c1ccc(F)c(F)c1
Show InChI InChI=1S/C15H10F2N4O3/c1-5-9-10(6-2-3-7(16)8(17)4-6)11-12(22)18-15(23)19-13(11)24-14(9)21-20-5/h2-4,10H,1H3,(H,20,21)(H2,18,19,22,23)
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35n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of N-terminus 6xHis-tagged human IDO1 expressed in Escherichia coli M15 using L-tryptophan as substrate preincubated for 1 hr measured aft...


ACS Med Chem Lett 7: 1167-1172 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00359
BindingDB Entry DOI: 10.7270/Q2TF009K
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM21975
PNG
((4S)-16'-(2-aminoethyl)-9'-hydroxy-1,3,6',6'-tetra...)
Show SMILES CN1C(=O)N(C)[C@@]2(Oc3c(O)cc4c(CC[N+]4(C)C)c3C3=C2C(=O)c2c(CCN)c[nH]c2C3=O)C1=O
Show InChI InChI=1S/C25H25N5O6/c1-28-23(34)25(29(2)24(28)35)18-17(21(33)19-15(20(18)32)11(5-7-26)10-27-19)16-12-6-8-30(3,4)13(12)9-14(31)22(16)36-25/h9-10H,5-8,26H2,1-4H3,(H-,27,31,32,33)/p+1/t25-/m0/s1
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41 -10.5n/an/an/an/an/a6.537



University of British Columbia



Assay Description
The ability of the compounds prepared in this study to inhibit purified recombinant human IDO was evaluated with a steady state spectrophotometric as...


J Med Chem 51: 2634-7 (2008)


Article DOI: 10.1021/jm800143h
BindingDB Entry DOI: 10.7270/Q2MK6B65
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50324701
PNG
(CHEMBL1221472 | Exiguamine A)
Show SMILES CN1C(=O)N(C)[C@]2(Oc3c(O)cc4c(CC[N+]4(C)C)c3C3=C2C(=O)c2c(CCN)c[nH]c2C3=O)C1=O
Show InChI InChI=1S/C25H25N5O6/c1-28-23(34)25(29(2)24(28)35)18-17(21(33)19-15(20(18)32)11(5-7-26)10-27-19)16-12-6-8-30(3,4)13(12)9-14(31)22(16)36-25/h9-10H,5-8,26H2,1-4H3,(H-,27,31,32,33)/p+1/t25-/m1/s1
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41n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human recombinant indoleamine-2,3-dioxygenase


Nat Chem Biol 4: 535-7 (2008)


Article DOI: 10.1038/nchembio.107
BindingDB Entry DOI: 10.7270/Q2P55NR5
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50442991
PNG
(CHEMBL432537 | GNF-Pf-3777)
Show SMILES [O-][N+](=O)c1ccc-2c(c1)C(=O)c1nc3ccccc3c(=O)n-21
Show InChI InChI=1S/C15H7N3O4/c19-13-10-7-8(18(21)22)5-6-12(10)17-14(13)16-11-4-2-1-3-9(11)15(17)20/h1-7H
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54n/an/an/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Uncompetitive inhibition of human recombinant IDO1 using L-tryptophan as substrate


J Med Chem 56: 8321-31 (2013)


Article DOI: 10.1021/jm401195n
BindingDB Entry DOI: 10.7270/Q2X34ZWS
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50324700
PNG
(CHEMBL1221412 | Exiguamine B)
Show SMILES CN1C(=O)N(C)[C@]2(Oc3c(O)cc4c([C@H](O)C[N+]4(C)C)c3C3=C2C(=O)c2c(CCN)c[nH]c2C3=O)C1=O
Show InChI InChI=1S/C25H25N5O7/c1-28-23(35)25(29(2)24(28)36)18-17(21(34)19-14(20(18)33)10(5-6-26)8-27-19)16-15-11(7-12(31)22(16)37-25)30(3,4)9-13(15)32/h7-8,13,32H,5-6,9,26H2,1-4H3,(H-,27,31,33,34)/p+1/t13-,25-/m1/s1
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80n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human recombinant indoleamine-2,3-dioxygenase


Nat Chem Biol 4: 535-7 (2008)


Article DOI: 10.1038/nchembio.107
BindingDB Entry DOI: 10.7270/Q2P55NR5
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50324699
PNG
(CHEMBL1221473 | Seco-exiguamine)
Show SMILES CN(C)CCc1ccc(O)c(O)c1C1=C(c2c(O)n(C)c(=O)n2C)C(=O)c2c(CCN)c[nH]c2C1=O
Show InChI InChI=1S/C25H29N5O6/c1-28(2)10-8-12-5-6-14(31)21(32)15(12)17-18(20-24(35)30(4)25(36)29(20)3)22(33)16-13(7-9-26)11-27-19(16)23(17)34/h5-6,11,27,31-32,35H,7-10,26H2,1-4H3
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80n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human recombinant indoleamine-2,3-dioxygenase


Nat Chem Biol 4: 535-7 (2008)


Article DOI: 10.1038/nchembio.107
BindingDB Entry DOI: 10.7270/Q2P55NR5
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))
BDBM50013811
PNG
(9H-beta-Carboline | 9H-pyrido[3,4-b]indole | CHEMB...)
Show SMILES c1ccc2c(c1)[nH]c1cnccc21
Show InChI InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H
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120n/an/an/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of IDO


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
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