Compile Data Set for Download or QSAR

Found 50 hits with Last Name = 'lugari' and Initial = 'a'   

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
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326574 (6-phenylpyridazin-3-yl thiophene-2-carboxylate | C...) Show SMILES O=C(Oc1ccc(nn1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C15H10N2O2S/c18-15(13-7-4-10-20-13)19-14-9-8-12(16-17-14)11-5-2-1-3-6-11/h1-10H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326574 (6-phenylpyridazin-3-yl thiophene-2-carboxylate | C...) Show SMILES O=C(Oc1ccc(nn1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C15H10N2O2S/c18-15(13-7-4-10-20-13)19-14-9-8-12(16-17-14)11-5-2-1-3-6-11/h1-10H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM33627 ((1,3-benzoxazol-2-ylthio)formic acid butyl ester |...) Show SMILES CCCCOC(=O)Sc1nc2ccccc2o1 Show InChI InChI=1S/C12H13NO3S/c1-2-3-8-15-12(14)17-11-13-9-6-4-5-7-10(9)16-11/h4-7H,2-3,8H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM33627 ((1,3-benzoxazol-2-ylthio)formic acid butyl ester |...) Show SMILES CCCCOC(=O)Sc1nc2ccccc2o1 Show InChI InChI=1S/C12H13NO3S/c1-2-3-8-15-12(14)17-11-13-9-6-4-5-7-10(9)16-11/h4-7H,2-3,8H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326573 (1-Phenyl-3-(2-thiazolyl)-2-thiourea | 1-phenyl-3-(...) Show SMILES S=C(Nc1nncs1)Nc1ccccc1 Show InChI InChI=1S/C9H8N4S2/c14-8(12-9-13-10-6-15-9)11-7-4-2-1-3-5-7/h1-6H,(H2,11,12,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326573 (1-Phenyl-3-(2-thiazolyl)-2-thiourea | 1-phenyl-3-(...) Show SMILES S=C(Nc1nncs1)Nc1ccccc1 Show InChI InChI=1S/C9H8N4S2/c14-8(12-9-13-10-6-15-9)11-7-4-2-1-3-5-7/h1-6H,(H2,11,12,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM47541 (1-(2-chlorophenyl)-3-(2-pyridinyl)thiourea | 1-(2-...) Show SMILES Clc1ccccc1NC(=S)Nc1ccccn1 Show InChI InChI=1S/C12H10ClN3S/c13-9-5-1-2-6-10(9)15-12(17)16-11-7-3-4-8-14-11/h1-8H,(H2,14,15,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM47541 (1-(2-chlorophenyl)-3-(2-pyridinyl)thiourea | 1-(2-...) Show SMILES Clc1ccccc1NC(=S)Nc1ccccn1 Show InChI InChI=1S/C12H10ClN3S/c13-9-5-1-2-6-10(9)15-12(17)16-11-7-3-4-8-14-11/h1-8H,(H2,14,15,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 2 (Homo sapiens (Human))	BDBM50150754 (CHEMBL3775058) Show SMILES CCn1cnc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C14H13ClN4O2/c1-2-18-8-16-12-11(18)13(20)17-14(21)19(12)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,17,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD2 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 3 (Homo sapiens (Human))	BDBM50150754 (CHEMBL3775058) Show SMILES CCn1cnc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C14H13ClN4O2/c1-2-18-8-16-12-11(18)13(20)17-14(21)19(12)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,17,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD3 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 3 (Homo sapiens (Human))	BDBM50150754 (CHEMBL3775058) Show SMILES CCn1cnc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C14H13ClN4O2/c1-2-18-8-16-12-11(18)13(20)17-14(21)19(12)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,17,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of human BRD3 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150754 (CHEMBL3775058) Show SMILES CCn1cnc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C14H13ClN4O2/c1-2-18-8-16-12-11(18)13(20)17-14(21)19(12)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,17,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD4 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain testis-specific protein (Homo sapiens (Human))	BDBM50150754 (CHEMBL3775058) Show SMILES CCn1cnc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C14H13ClN4O2/c1-2-18-8-16-12-11(18)13(20)17-14(21)19(12)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,17,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRDT bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150754 (CHEMBL3775058) Show SMILES CCn1cnc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C14H13ClN4O2/c1-2-18-8-16-12-11(18)13(20)17-14(21)19(12)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,17,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD4 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair				3D Structure (crystal)
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326572 (CHEMBL1253383 | N-(2-bromobenzoyloxy)-4-chlorobenz...) Show SMILES Clc1ccc(cc1)C(=O)NOC(=O)c1ccccc1Br Show InChI InChI=1S/C14H9BrClNO3/c15-12-4-2-1-3-11(12)14(19)20-17-13(18)9-5-7-10(16)8-6-9/h1-8H,(H,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326572 (CHEMBL1253383 | N-(2-bromobenzoyloxy)-4-chlorobenz...) Show SMILES Clc1ccc(cc1)C(=O)NOC(=O)c1ccccc1Br Show InChI InChI=1S/C14H9BrClNO3/c15-12-4-2-1-3-11(12)14(19)20-17-13(18)9-5-7-10(16)8-6-9/h1-8H,(H,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 2 (Homo sapiens (Human))	BDBM50150754 (CHEMBL3775058) Show SMILES CCn1cnc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C14H13ClN4O2/c1-2-18-8-16-12-11(18)13(20)17-14(21)19(12)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,17,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD2 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 3 (Homo sapiens (Human))	BDBM50150755 (CHEMBL3775270) Show SMILES CCCCn1c2ncn(CC)c2c(=O)[nH]c1=O Show InChI InChI=1S/C11H16N4O2/c1-3-5-6-15-9-8(10(16)13-11(15)17)14(4-2)7-12-9/h7H,3-6H2,1-2H3,(H,13,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD3 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150069 (CHEMBL3774931) Show SMILES CCCCc1c(C)nc2nc(SCc3nc4n(CCCC)c(=O)[nH]c(=O)c4n3CC)nn2c1C Show InChI InChI=1S/C23H32N8O2S/c1-6-9-11-16-14(4)24-21-27-22(28-31(21)15(16)5)34-13-17-25-19-18(29(17)8-3)20(32)26-23(33)30(19)12-10-7-2/h6-13H2,1-5H3,(H,26,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD4 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 3 (Homo sapiens (Human))	BDBM50150755 (CHEMBL3775270) Show SMILES CCCCn1c2ncn(CC)c2c(=O)[nH]c1=O Show InChI InChI=1S/C11H16N4O2/c1-3-5-6-15-9-8(10(16)13-11(15)17)14(4-2)7-12-9/h7H,3-6H2,1-2H3,(H,13,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of human BRD3 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 2 (Homo sapiens (Human))	BDBM50150755 (CHEMBL3775270) Show SMILES CCCCn1c2ncn(CC)c2c(=O)[nH]c1=O Show InChI InChI=1S/C11H16N4O2/c1-3-5-6-15-9-8(10(16)13-11(15)17)14(4-2)7-12-9/h7H,3-6H2,1-2H3,(H,13,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD2 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326570 ((1H-benzo[d][1,2,3]triazol-1-yl)(2-methoxyphenyl)m...) Show SMILES COc1ccccc1C(=O)n1nnc2ccccc12 Show InChI InChI=1S/C14H11N3O2/c1-19-13-9-5-2-6-10(13)14(18)17-12-8-4-3-7-11(12)15-16-17/h2-9H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain testis-specific protein (Homo sapiens (Human))	BDBM50150755 (CHEMBL3775270) Show SMILES CCCCn1c2ncn(CC)c2c(=O)[nH]c1=O Show InChI InChI=1S/C11H16N4O2/c1-3-5-6-15-9-8(10(16)13-11(15)17)14(4-2)7-12-9/h7H,3-6H2,1-2H3,(H,13,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRDT bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150755 (CHEMBL3775270) Show SMILES CCCCn1c2ncn(CC)c2c(=O)[nH]c1=O Show InChI InChI=1S/C11H16N4O2/c1-3-5-6-15-9-8(10(16)13-11(15)17)14(4-2)7-12-9/h7H,3-6H2,1-2H3,(H,13,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD4 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326571 (5-(2-nitro-4-(trifluoromethylsulfonyl)phenylthio)-...) Show SMILES [O-][N+](=O)c1cc(ccc1Sc1nnc(S)s1)S(=O)(=O)C(F)(F)F Show InChI InChI=1S/C9H4F3N3O4S4/c10-9(11,12)23(18,19)4-1-2-6(5(3-4)15(16)17)21-8-14-13-7(20)22-8/h1-3H,(H,13,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326570 ((1H-benzo[d][1,2,3]triazol-1-yl)(2-methoxyphenyl)m...) Show SMILES COc1ccccc1C(=O)n1nnc2ccccc12 Show InChI InChI=1S/C14H11N3O2/c1-19-13-9-5-2-6-10(13)14(18)17-12-8-4-3-7-11(12)15-16-17/h2-9H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150755 (CHEMBL3775270) Show SMILES CCCCn1c2ncn(CC)c2c(=O)[nH]c1=O Show InChI InChI=1S/C11H16N4O2/c1-3-5-6-15-9-8(10(16)13-11(15)17)14(4-2)7-12-9/h7H,3-6H2,1-2H3,(H,13,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD4 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326569 (CHEMBL1253492 | methyl 2-(4-methyl-5-(thiophen-2-y...) Show SMILES COC(=O)CSc1nnc(-c2cccs2)n1C Show InChI InChI=1S/C10H11N3O2S2/c1-13-9(7-4-3-5-16-7)11-12-10(13)17-6-8(14)15-2/h3-5H,6H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.86E+4	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 2 (Homo sapiens (Human))	BDBM50150755 (CHEMBL3775270) Show SMILES CCCCn1c2ncn(CC)c2c(=O)[nH]c1=O Show InChI InChI=1S/C11H16N4O2/c1-3-5-6-15-9-8(10(16)13-11(15)17)14(4-2)7-12-9/h7H,3-6H2,1-2H3,(H,13,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.88E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD2 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150753 (CHEMBL3775772) Show SMILES CCCCc1c(C)nc2nc(SCc3nc4n(Cc5ccc(Cl)cc5)c(=O)[nH]c(=O)c4n3CC)nn2c1C Show InChI InChI=1S/C26H29ClN8O2S/c1-5-7-8-19-15(3)28-24-31-25(32-35(24)16(19)4)38-14-20-29-22-21(33(20)6-2)23(36)30-26(37)34(22)13-17-9-11-18(27)12-10-17/h9-12H,5-8,13-14H2,1-4H3,(H,30,36,37)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD4 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150752 (CHEMBL3774900) Show SMILES CCn1c(CSc2n[nH]c(N)n2)nc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C17H17ClN8O2S/c1-2-25-11(8-29-16-22-15(19)23-24-16)20-13-12(25)14(27)21-17(28)26(13)7-9-3-5-10(18)6-4-9/h3-6H,2,7-8H2,1H3,(H,21,27,28)(H3,19,22,23,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.64E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD4 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326569 (CHEMBL1253492 | methyl 2-(4-methyl-5-(thiophen-2-y...) Show SMILES COC(=O)CSc1nnc(-c2cccs2)n1C Show InChI InChI=1S/C10H11N3O2S2/c1-13-9(7-4-3-5-16-7)11-12-10(13)17-6-8(14)15-2/h3-5H,6H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 2 (Homo sapiens (Human))	BDBM50150752 (CHEMBL3774900) Show SMILES CCn1c(CSc2n[nH]c(N)n2)nc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C17H17ClN8O2S/c1-2-25-11(8-29-16-22-15(19)23-24-16)20-13-12(25)14(27)21-17(28)26(13)7-9-3-5-10(18)6-4-9/h3-6H,2,7-8H2,1H3,(H,21,27,28)(H3,19,22,23,24)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD2 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain-containing protein 3 (Homo sapiens (Human))	BDBM50150752 (CHEMBL3774900) Show SMILES CCn1c(CSc2n[nH]c(N)n2)nc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C17H17ClN8O2S/c1-2-25-11(8-29-16-22-15(19)23-24-16)20-13-12(25)14(27)21-17(28)26(13)7-9-3-5-10(18)6-4-9/h3-6H,2,7-8H2,1H3,(H,21,27,28)(H3,19,22,23,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.17E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD3 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50096008 (3-Acetyl-7-hydroxy-chromen-2-one | 3-acetyl-7-hydr...) Show SMILES CC(=O)c1cc2ccc(O)cc2oc1=O Show InChI InChI=1S/C11H8O4/c1-6(12)9-4-7-2-3-8(13)5-10(7)15-11(9)14/h2-5,13H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150714 (CHEMBL3775080) Show SMILES CCCCn1c2nc(CSc3n[nH]c(N)n3)n(CC)c2c(=O)[nH]c1=O Show InChI InChI=1S/C14H20N8O2S/c1-3-5-6-22-10-9(11(23)17-14(22)24)21(4-2)8(16-10)7-25-13-18-12(15)19-20-13/h3-7H2,1-2H3,(H,17,23,24)(H3,15,18,19,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD4 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326576 (3-(2,4-difluorophenylamino)-1-(5-methylfuran-2-yl)...) Show SMILES Cc1ccc(o1)C(=O)CC=Nc1ccc(F)cc1F |w:9.9| Show InChI InChI=1S/C14H11F2NO2/c1-9-2-5-14(19-9)13(18)6-7-17-12-4-3-10(15)8-11(12)16/h2-5,7-8H,6H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.75E+4	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 2 (Homo sapiens (Human))	BDBM50150069 (CHEMBL3774931) Show SMILES CCCCc1c(C)nc2nc(SCc3nc4n(CCCC)c(=O)[nH]c(=O)c4n3CC)nn2c1C Show InChI InChI=1S/C23H32N8O2S/c1-6-9-11-16-14(4)24-21-27-22(28-31(21)15(16)5)34-13-17-25-19-18(29(17)8-3)20(32)26-23(33)30(19)12-10-7-2/h6-13H2,1-5H3,(H,26,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	5.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD2 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326568 (CHEMBL1253493 | N-(furan-2-ylmethyl)-7-nitrobenzo[...) Show SMILES [O-][N+](=O)c1ccc(NCc2ccco2)c2nonc12 Show InChI InChI=1S/C11H8N4O4/c16-15(17)9-4-3-8(10-11(9)14-19-13-10)12-6-7-2-1-5-18-7/h1-5,12H,6H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 3 (Homo sapiens (Human))	BDBM50150069 (CHEMBL3774931) Show SMILES CCCCc1c(C)nc2nc(SCc3nc4n(CCCC)c(=O)[nH]c(=O)c4n3CC)nn2c1C Show InChI InChI=1S/C23H32N8O2S/c1-6-9-11-16-14(4)24-21-27-22(28-31(21)15(16)5)34-13-17-25-19-18(29(17)8-3)20(32)26-23(33)30(19)12-10-7-2/h6-13H2,1-5H3,(H,26,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRD3 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326567 (CHEMBL1253544 | ethyl 2-cyano-3-(2,4-dihydroxyphen...) Show SMILES CCOC(=O)C(=C\c1ccc(O)cc1O)\C#N Show InChI InChI=1S/C12H11NO4/c1-2-17-12(16)9(7-13)5-8-3-4-10(14)6-11(8)15/h3-6,14-15H,2H2,1H3/b9-5+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM52230 ((Z)-2-(1,3-benzoxazol-2-yl)-3-(2-pyridinylamino)-2...) Show SMILES O=CC(C=Nc1ccccn1)c1nc2ccccc2o1 |w:4.4| Show InChI InChI=1S/C15H11N3O2/c19-10-11(9-17-14-7-3-4-8-16-14)15-18-12-5-1-2-6-13(12)20-15/h1-11H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain testis-specific protein (Homo sapiens (Human))	BDBM50150069 (CHEMBL3774931) Show SMILES CCCCc1c(C)nc2nc(SCc3nc4n(CCCC)c(=O)[nH]c(=O)c4n3CC)nn2c1C Show InChI InChI=1S/C23H32N8O2S/c1-6-9-11-16-14(4)24-21-27-22(28-31(21)15(16)5)34-13-17-25-19-18(29(17)8-3)20(32)26-23(33)30(19)12-10-7-2/h6-13H2,1-5H3,(H,26,32,33)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRDT bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Bromodomain testis-specific protein (Homo sapiens (Human))	BDBM50150752 (CHEMBL3774900) Show SMILES CCn1c(CSc2n[nH]c(N)n2)nc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C17H17ClN8O2S/c1-2-25-11(8-29-16-22-15(19)23-24-16)20-13-12(25)14(27)21-17(28)26(13)7-9-3-5-10(18)6-4-9/h3-6H,2,7-8H2,1H3,(H,21,27,28)(H3,19,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human BRDT bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
ATPase family AAA domain-containing protein 2 (Homo sapiens (Human))	BDBM50150069 (CHEMBL3774931) Show SMILES CCCCc1c(C)nc2nc(SCc3nc4n(CCCC)c(=O)[nH]c(=O)c4n3CC)nn2c1C Show InChI InChI=1S/C23H32N8O2S/c1-6-9-11-16-14(4)24-21-27-22(28-31(21)15(16)5)34-13-17-25-19-18(29(17)8-3)20(32)26-23(33)30(19)12-10-7-2/h6-13H2,1-5H3,(H,26,32,33)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of GST-tagged human ATAD2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50096008 (3-Acetyl-7-hydroxy-chromen-2-one | 3-acetyl-7-hydr...) Show SMILES CC(=O)c1cc2ccc(O)cc2oc1=O Show InChI InChI=1S/C11H8O4/c1-6(12)9-4-7-2-3-8(13)5-10(7)15-11(9)14/h2-5,13H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.03E+5	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326567 (CHEMBL1253544 | ethyl 2-cyano-3-(2,4-dihydroxyphen...) Show SMILES CCOC(=O)C(=C\c1ccc(O)cc1O)\C#N Show InChI InChI=1S/C12H11NO4/c1-2-17-12(16)9(7-13)5-8-3-4-10(14)6-11(8)15/h3-6,14-15H,2H2,1H3/b9-5+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity in presence of Triton X-100 as detergent				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Macrophage migration inhibitory factor (Homo sapiens (Human))	BDBM50326577 (3-nitroso-2-phenylindolizine | CHEMBL1253586) Show SMILES O=Nc1c(cc2ccccn12)-c1ccccc1 Show InChI InChI=1S/C14H10N2O/c17-15-14-13(11-6-2-1-3-7-11)10-12-8-4-5-9-16(12)14/h1-10H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.21E+5	n/a	n/a	n/a	n/a	n/a	n/a
Brain Mind Institute Curated by ChEMBL					Assay Description Inhibition of human MIF tautomerase activity				Bioorg Med Chem 18: 5425-40 (2010) Article DOI: 10.1016/j.bmc.2010.05.010 BindingDB Entry DOI: 10.7270/Q2KH0P9C
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150069 (CHEMBL3774931) Show SMILES CCCCc1c(C)nc2nc(SCc3nc4n(CCCC)c(=O)[nH]c(=O)c4n3CC)nn2c1C Show InChI InChI=1S/C23H32N8O2S/c1-6-9-11-16-14(4)24-21-27-22(28-31(21)15(16)5)34-13-17-25-19-18(29(17)8-3)20(32)26-23(33)30(19)12-10-7-2/h6-13H2,1-5H3,(H,26,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Binding affinity to his-tagged human BRD4 bromodomain1 by isothermal titration calorimetric analysis				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50150754 (CHEMBL3775058) Show SMILES CCn1cnc2n(Cc3ccc(Cl)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C14H13ClN4O2/c1-2-18-8-16-12-11(18)13(20)17-14(21)19(12)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,17,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Binding affinity to his-tagged human BRD4 bromodomain1 by isothermal titration calorimetric analysis				J Med Chem 59: 1634-41 (2016) Article DOI: 10.1021/acs.jmedchem.5b01708 BindingDB Entry DOI: 10.7270/Q21N830R
					More data for this Ligand-Target Pair				3D Structure (crystal)