Compile Data Set for Download or QSAR

Found 33 hits with Last Name = 'jamie' and Initial = 'jf'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50300296 (4-Amino-N-(3-chlorophenyl)-N'-hydroxy-1,2,5-oxadia...) Show SMILES Nc1nonc1C(NO)=Nc1cccc(Cl)c1 |w:9.10| Show InChI InChI=1S/C9H8ClN5O2/c10-5-2-1-3-6(4-5)12-9(13-16)7-8(11)15-17-14-7/h1-4,16H,(H2,11,15)(H,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	86	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1 by magnetic circular dichroism spectroscopic analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50325571 (3,4-Dichlorobenzenemethanethiol | CHEMBL1224626) Show SMILES SCc1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C7H6Cl2S/c8-6-2-1-5(4-10)3-7(6)9/h1-3,10H,4H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Mus musculus)	BDBM50444455 (CHEBI:27924 | Phenylhydrazine) Show SMILES NNc1ccccc1 Show InChI InChI=1S/C6H8N2/c7-8-6-4-2-1-3-5-6/h1-5,8H,7H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of mouse IDO1 expressed in mouse LLTC cells using L-tryptophan as substrate after 24 hrs				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50444455 (CHEBI:27924 | Phenylhydrazine) Show SMILES NNc1ccccc1 Show InChI InChI=1S/C6H8N2/c7-8-6-4-2-1-3-5-6/h1-5,8H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of recombinant human IDO1 expressed in Escherichia coli EC538 using L-tryptophan as substrate after 1 hr				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50325541 (CHEMBL1224483 | CHEMBL1229058 | S-(2,4-Dichloroben...) Show SMILES NC(=N)SCc1ccc(Cl)cc1Cl Show InChI InChI=1S/C8H8Cl2N2S/c9-6-2-1-5(7(10)3-6)4-13-8(11)12/h1-3H,4H2,(H3,11,12)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50300312 (4-amino-1,2,5-oxadiazole-3-carboximidamide | CHEMB...) Show SMILES Nc1nonc1C(NO)=NCc1ccccc1 |w:9.10| Show InChI InChI=1S/C10H11N5O2/c11-9-8(14-17-15-9)10(13-16)12-6-7-4-2-1-3-5-7/h1-5,16H,6H2,(H2,11,15)(H,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1 by magnetic circular dichroism spectroscopic analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50444455 (CHEBI:27924 | Phenylhydrazine) Show SMILES NNc1ccccc1 Show InChI InChI=1S/C6H8N2/c7-8-6-4-2-1-3-5-6/h1-5,8H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of human IDO1 expressed in mouse LLTC cells using L-tryptophan as substrate after 24 hrs				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50300308 (4-Amino-N-(3-chlorophenyl)-1,2,5-oxadiazole-3-carb...) Show SMILES NC(=Nc1cccc(Cl)c1)c1nonc1N |w:2.2| Show InChI InChI=1S/C9H8ClN5O/c10-5-2-1-3-6(4-5)13-8(11)7-9(12)15-16-14-7/h1-4H,(H2,11,13)(H2,12,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1 by magnetic circular dichroism spectroscopic analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50444457 (CHEMBL3092383) Show SMILES NNc1nc2cc(Cl)ccc2s1 Show InChI InChI=1S/C7H6ClN3S/c8-4-1-2-6-5(3-4)10-7(11-9)12-6/h1-3H,9H2,(H,10,11)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of recombinant human IDO1 expressed in Escherichia coli EC538 using L-tryptophan as substrate after 1 hr				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50300302 (4-Amino-N'-hydroxy-N-(3-isopropylphenyl)-1,2,5-oxa...) Show SMILES CC(C)c1cccc(c1)N=C(NO)c1nonc1N |w:9.9| Show InChI InChI=1S/C12H15N5O2/c1-7(2)8-4-3-5-9(6-8)14-12(15-18)10-11(13)17-19-16-10/h3-7,18H,1-2H3,(H2,13,17)(H,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1 by magnetic circular dichroism spectroscopic analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50325570 (2,4-Dichlorobenzenemethanethiol | CHEMBL1224561) Show SMILES SCc1ccc(Cl)cc1Cl Show InChI InChI=1S/C7H6Cl2S/c8-6-2-1-5(4-10)7(9)3-6/h1-3,10H,4H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50300297 (4-Amino-N-(4-chlorophenyl)-N'-hydroxy-1,2,5-oxadia...) Show SMILES Nc1nonc1C(NO)=Nc1ccc(Cl)cc1 |w:9.10| Show InChI InChI=1S/C9H8ClN5O2/c10-5-1-3-6(4-2-5)12-9(13-16)7-8(11)15-17-14-7/h1-4,16H,(H2,11,15)(H,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1 by magnetic circular dichroism spectroscopic analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50444456 (2-Hydrazinylbenzo[D]Thiazole | CHEMBL1933308) Show SMILES NNc1nc2ccccc2s1 Show InChI InChI=1S/C7H7N3S/c8-10-7-9-5-3-1-2-4-6(5)11-7/h1-4H,8H2,(H,9,10)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of recombinant human IDO1 expressed in Escherichia coli EC538 using L-tryptophan as substrate after 1 hr				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50241727 ((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	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by spectrophotometric analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50325537 (CHEMBL1224310 | CHEMBL1229095 | S-(2-Chlorobenzyl)...) Show SMILES NC(=N)SCc1ccccc1Cl Show InChI InChI=1S/C8H9ClN2S/c9-7-4-2-1-3-6(7)5-12-8(10)11/h1-4H,5H2,(H3,10,11)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50360482 (CHEMBL1935084) Show SMILES Nc1cc2ccccc2cc1C(O)=O Show InChI InChI=1S/C11H9NO2/c12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14/h1-6H,12H2,(H,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by spectrophotometric analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50360489 (CHEMBL1935087) Show SMILES [O-][N+](=O)c1cc(ccc1Oc1ccc(cc1)C(=[NH2+])[N-]OC(=O)c1cc2ccccc2oc1=O)C(F)(F)F Show InChI InChI=1S/C24H13F3N3O7/c25-24(26,27)15-7-10-20(18(12-15)30(33)34)35-16-8-5-13(6-9-16)21(28)29-37-23(32)17-11-14-3-1-2-4-19(14)36-22(17)31/h1-12H,(H-,28,29)/q-1/p+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by Ehrlich's method				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50360491 (CHEMBL1935098) Show SMILES Cc1nnsc1C(=O)ONC(=N)COc1ccc(cc1)C1SCCS1 Show InChI InChI=1S/C15H16N4O3S3/c1-9-13(25-19-17-9)14(20)22-18-12(16)8-21-11-4-2-10(3-5-11)15-23-6-7-24-15/h2-5,15H,6-8H2,1H3,(H2,16,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by Ehrlich's method				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50360488 (CHEMBL1414365) Show SMILES Nc1ccc2SC3=NCCN3c2c1 |t:6| Show InChI InChI=1S/C9H9N3S/c10-6-1-2-8-7(5-6)12-4-3-11-9(12)13-8/h1-2,5H,3-4,10H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by HPLC analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Mus musculus)	BDBM50444456 (2-Hydrazinylbenzo[D]Thiazole | CHEMBL1933308) Show SMILES NNc1nc2ccccc2s1 Show InChI InChI=1S/C7H7N3S/c8-10-7-9-5-3-1-2-4-6(5)11-7/h1-4H,8H2,(H,9,10)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of mouse IDO1 expressed in mouse LLTC cells using L-tryptophan as substrate after 24 hrs				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50325556 (CHEMBL1224487 | CHEMBL1229062 | S-(4-Chloropheneth...) Show SMILES NC(=N)SCCc1ccc(Cl)cc1 Show InChI InChI=1S/C9H11ClN2S/c10-8-3-1-7(2-4-8)5-6-13-9(11)12/h1-4H,5-6H2,(H3,11,12)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50360490 (CHEMBL1935094) Show SMILES NC(=NOC(=O)c1ccccc1Cl)c1cccc(CS(=O)(=O)c2ccc(Cl)cc2)c1 |w:2.2| Show InChI InChI=1S/C21H16Cl2N2O4S/c22-16-8-10-17(11-9-16)30(27,28)13-14-4-3-5-15(12-14)20(24)25-29-21(26)18-6-1-2-7-19(18)23/h1-12H,13H2,(H2,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by Ehrlich's method				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50271830 (2-Benzyl-isothiourea | CHEMBL1224309 | CHEMBL50566...) Show SMILES NC(=N)SCc1ccccc1 Show InChI InChI=1S/C8H10N2S/c9-8(10)11-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50444456 (2-Hydrazinylbenzo[D]Thiazole | CHEMBL1933308) Show SMILES NNc1nc2ccccc2s1 Show InChI InChI=1S/C7H7N3S/c8-10-7-9-5-3-1-2-4-6(5)11-7/h1-4H,8H2,(H,9,10)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of human IDO1 expressed in mouse LLTC cells using L-tryptophan as substrate after 24 hrs				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50013811 (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	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	9.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by spectrophotometric analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50444459 (2-Mercaptobenzothiazole | 2-Mercaptobenzothioazole...) Show SMILES Sc1nc2ccccc2s1 Show InChI InChI=1S/C7H5NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of recombinant human IDO1 expressed in Escherichia coli EC538 using L-tryptophan as substrate after 1 hr				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50360483 (CHEMBL1935085) Show SMILES Nc1cc2ccccc2cc1CO Show InChI InChI=1S/C11H11NO/c12-11-6-9-4-2-1-3-8(9)5-10(11)7-13/h1-6,13H,7,12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+5	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by spectrophotometric analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50360484 (CHEMBL145337) Show SMILES COC(=O)c1cc2ccccc2cc1N Show InChI InChI=1S/C12H11NO2/c1-15-12(14)10-6-8-4-2-3-5-9(8)7-11(10)13/h2-7H,13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by spectrophotometric analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50444458 (BENZOTHIAZYL DISULFIDE | BI-87F4 | CHEBI:53239) Show SMILES S(Sc1nc2ccccc2s1)c1nc2ccccc2s1 Show InChI InChI=1S/C14H8N2S4/c1-3-7-11-9(5-1)15-13(17-11)19-20-14-16-10-6-2-4-8-12(10)18-14/h1-8H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of recombinant human IDO1 expressed in Escherichia coli EC538 using L-tryptophan as substrate after 1 hr				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50335098 (6-Nitro-benzothiazol-2-ylamine | 6-nitrobenzo[d]th...) Show SMILES Nc1nc2ccc(cc2s1)[N+]([O-])=O Show InChI InChI=1S/C7H5N3O2S/c8-7-9-5-2-1-4(10(11)12)3-6(5)13-7/h1-3H,(H2,8,9)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of recombinant human IDO1 expressed in Escherichia coli EC538 using L-tryptophan as substrate after 1 hr				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50444460 (Benzo[D]Thiazole | Benzothiazole | CHEBI:45993) Show SMILES c1nc2ccccc2s1 Show InChI InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.52E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of recombinant human IDO1 expressed in Escherichia coli EC538 using L-tryptophan as substrate after 1 hr				Bioorg Med Chem 21: 7595-603 (2013) Article DOI: 10.1016/j.bmc.2013.10.037 BindingDB Entry DOI: 10.7270/Q2377B6F
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50219485 (3-hydroxy-2-naphthoic acid | CHEMBL122279 | CHEMBL...) Show SMILES OC(=O)c1cc2ccccc2cc1O Show InChI InChI=1S/C11H8O3/c12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14/h1-6,12H,(H,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of His-tagged recombinant human IDO1 expressed in Escherichia coli using tryptophan as substrate by spectrophotometric analysis				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair
Indoleamine 2,3-dioxygenase 1 (Homo sapiens (Human))	BDBM50047009 (1-Methyl-9H-beta-carbolin-7-ol | 1-Methyl-9H-beta-...) Show SMILES Cc1nccc2c3ccc(O)cc3[nH]c12 Show InChI InChI=1S/C12H10N2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12/h2-6,14-15H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Macquarie University Curated by ChEMBL					Assay Description Inhibition of IDO1				Bioorg Med Chem 20: 1354-63 (2012) Article DOI: 10.1016/j.bmc.2011.10.068 BindingDB Entry DOI: 10.7270/Q28P60ZT
					More data for this Ligand-Target Pair