Compile Data Set for Download or QSAR

Found 55 hits with Last Name = 'shetty' and Initial = 'n'   

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
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511629 (CHEMBL4559074) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CCC(F)(F)C(CO)C3)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C23H29ClF2N6O3/c1-22(2,35)6-9-32-18-10-15(4-5-17(18)30(3)21(32)34)28-19-16(24)11-27-20(29-19)31-8-7-23(25,26)14(12-31)13-33/h4-5,10-11,14,33,35H,6-9,12-13H2,1-3H3,(H,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	86	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511625 (CHEMBL4574515) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CC(C)(C)OC(C)(C)C3)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C25H35ClN6O3/c1-23(2,34)10-11-32-19-12-16(8-9-18(19)30(7)22(32)33)28-20-17(26)13-27-21(29-20)31-14-24(3,4)35-25(5,6)15-31/h8-9,12-13,34H,10-11,14-15H2,1-7H3,(H,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	97	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511644 (CHEMBL4465387) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CCCC(CO)C3)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C23H31ClN6O3/c1-23(2,33)8-10-30-19-11-16(6-7-18(19)28(3)22(30)32)26-20-17(24)12-25-21(27-20)29-9-4-5-15(13-29)14-31/h6-7,11-12,15,31,33H,4-5,8-10,13-14H2,1-3H3,(H,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511624 (CHEMBL4476234) Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 |r| Show InChI InChI=1S/C23H31ClN6O3/c1-14-12-29(13-15(2)33-14)21-25-11-17(24)20(27-21)26-16-6-7-18-19(10-16)30(22(31)28(18)5)9-8-23(3,4)32/h6-7,10-11,14-15,32H,8-9,12-13H2,1-5H3,(H,25,26,27)/t14-,15+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511651 (CHEMBL4458261) Show SMILES C[C@H]1CN(C[C@@H](C)N1C)c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 |r| Show InChI InChI=1S/C24H34ClN7O2/c1-15-13-31(14-16(2)29(15)5)22-26-12-18(25)21(28-22)27-17-7-8-19-20(11-17)32(23(33)30(19)6)10-9-24(3,4)34/h7-8,11-12,15-16,34H,9-10,13-14H2,1-6H3,(H,26,27,28)/t15-,16+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511653 (CHEMBL4573672) Show SMILES COCC1CN(CCC1(F)F)c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C24H31ClF2N6O3/c1-23(2,35)7-10-33-19-11-16(5-6-18(19)31(3)22(33)34)29-20-17(25)12-28-21(30-20)32-9-8-24(26,27)15(13-32)14-36-4/h5-6,11-12,15,35H,7-10,13-14H2,1-4H3,(H,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511645 (CHEMBL4524719) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3C4CCC3CC(F)(F)C4)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C24H29ClF2N6O2/c1-23(2,35)8-9-32-19-10-14(4-7-18(19)31(3)22(32)34)29-20-17(25)13-28-21(30-20)33-15-5-6-16(33)12-24(26,27)11-15/h4,7,10,13,15-16,35H,5-6,8-9,11-12H2,1-3H3,(H,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511622 (CHEMBL4451702) Show SMILES Cc1cc(C)n(n1)-c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C22H26ClN7O2/c1-13-10-14(2)30(27-13)20-24-12-16(23)19(26-20)25-15-6-7-17-18(11-15)29(21(31)28(17)5)9-8-22(3,4)32/h6-7,10-12,32H,8-9H2,1-5H3,(H,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511648 (CHEMBL4463841) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CCOCC3)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C21H27ClN6O3/c1-21(2,30)6-7-28-17-12-14(4-5-16(17)26(3)20(28)29)24-18-15(22)13-23-19(25-18)27-8-10-31-11-9-27/h4-5,12-13,30H,6-11H2,1-3H3,(H,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511627 (CHEMBL4587209) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CCC(F)(F)CC3)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C22H27ClF2N6O2/c1-21(2,33)6-11-31-17-12-14(4-5-16(17)29(3)20(31)32)27-18-15(23)13-26-19(28-18)30-9-7-22(24,25)8-10-30/h4-5,12-13,33H,6-11H2,1-3H3,(H,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511628 (CHEMBL4439574) Show SMILES CC1CN(CCC1(F)F)c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C23H29ClF2N6O2/c1-14-13-31(9-8-23(14,25)26)20-27-12-16(24)19(29-20)28-15-5-6-17-18(11-15)32(21(33)30(17)4)10-7-22(2,3)34/h5-6,11-12,14,34H,7-10,13H2,1-4H3,(H,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511630 (CHEMBL4466680) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CCCC(C3)C#N)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C23H28ClN7O2/c1-23(2,33)8-10-31-19-11-16(6-7-18(19)29(3)22(31)32)27-20-17(24)13-26-21(28-20)30-9-4-5-15(12-25)14-30/h6-7,11,13,15,33H,4-5,8-10,14H2,1-3H3,(H,26,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511643 (CHEMBL4482923) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CCCC(C3)C(F)(F)F)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C23H28ClF3N6O2/c1-22(2,35)8-10-33-18-11-15(6-7-17(18)31(3)21(33)34)29-19-16(24)12-28-20(30-19)32-9-4-5-14(13-32)23(25,26)27/h6-7,11-12,14,35H,4-5,8-10,13H2,1-3H3,(H,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511646 (CHEMBL4583696) Show SMILES Cc1ccn(n1)-c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C21H24ClN7O2/c1-13-7-9-29(26-13)19-23-12-15(22)18(25-19)24-14-5-6-16-17(11-14)28(20(30)27(16)4)10-8-21(2,3)31/h5-7,9,11-12,31H,8,10H2,1-4H3,(H,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511636 (CHEMBL4450499) Show SMILES Cc1ccnn1-c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C21H24ClN7O2/c1-13-7-9-24-29(13)19-23-12-15(22)18(26-19)25-14-5-6-16-17(11-14)28(20(30)27(16)4)10-8-21(2,3)31/h5-7,9,11-12,31H,8,10H2,1-4H3,(H,23,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511641 (CHEMBL4475529) Show SMILES Cn1ccnc1-c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C21H24ClN7O2/c1-21(2,31)7-9-29-16-11-13(5-6-15(16)28(4)20(29)30)25-17-14(22)12-24-18(26-17)19-23-8-10-27(19)3/h5-6,8,10-12,31H,7,9H2,1-4H3,(H,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511632 (CHEMBL4445645) Show SMILES C[C@H]1CN(C[C@@H](C)C1(F)F)c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 |r| Show InChI InChI=1S/C24H31ClF2N6O2/c1-14-12-32(13-15(2)24(14,26)27)21-28-11-17(25)20(30-21)29-16-6-7-18-19(10-16)33(22(34)31(18)5)9-8-23(3,4)35/h6-7,10-11,14-15,35H,8-9,12-13H2,1-5H3,(H,28,29,30)/t14-,15+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511623 (CHEMBL4459012) Show SMILES CC1CCCN(C1)c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C23H31ClN6O2/c1-15-6-5-10-29(14-15)21-25-13-17(24)20(27-21)26-16-7-8-18-19(12-16)30(22(31)28(18)4)11-9-23(2,3)32/h7-8,12-13,15,32H,5-6,9-11,14H2,1-4H3,(H,25,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511619 (CHEMBL4483413) Show SMILES CSc1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C18H22ClN5O2S/c1-18(2,26)7-8-24-14-9-11(5-6-13(14)23(3)17(24)25)21-15-12(19)10-20-16(22-15)27-4/h5-6,9-10,26H,7-8H2,1-4H3,(H,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511609 (CHEMBL4548894) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)-n3cccn3)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C20H22ClN7O2/c1-20(2,30)7-10-27-16-11-13(5-6-15(16)26(3)19(27)29)24-17-14(21)12-22-18(25-17)28-9-4-8-23-28/h4-6,8-9,11-12,30H,7,10H2,1-3H3,(H,22,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511607 (CHEMBL4525209) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CC4CCC(C3)C4(F)F)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C24H29ClF2N6O2/c1-23(2,35)8-9-33-19-10-16(6-7-18(19)31(3)22(33)34)29-20-17(25)11-28-21(30-20)32-12-14-4-5-15(13-32)24(14,26)27/h6-7,10-11,14-15,35H,4-5,8-9,12-13H2,1-3H3,(H,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511642 (CHEMBL4547183) Show SMILES C[C@H]1C[C@@H](C)CN(C1)c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 |r| Show InChI InChI=1S/C24H33ClN6O2/c1-15-10-16(2)14-30(13-15)22-26-12-18(25)21(28-22)27-17-6-7-19-20(11-17)31(23(32)29(19)5)9-8-24(3,4)33/h6-7,11-12,15-16,33H,8-10,13-14H2,1-5H3,(H,26,27,28)/t15-,16+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511637 (CHEMBL4467613) Show SMILES Cc1cc(C)n(n1)-c1cc(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)c(Cl)cn1 Show InChI InChI=1S/C23H27ClN6O2/c1-14-10-15(2)30(27-14)21-12-18(17(24)13-25-21)26-16-6-7-19-20(11-16)29(22(31)28(19)5)9-8-23(3,4)32/h6-7,10-13,32H,8-9H2,1-5H3,(H,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511652 (CHEMBL4572689) Show SMILES Cn1c2ccc(Nc3ccnc(Cl)c3C#N)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C19H20ClN5O2/c1-19(2,27)7-9-25-16-10-12(4-5-15(16)24(3)18(25)26)23-14-6-8-22-17(20)13(14)11-21/h4-6,8,10,27H,7,9H2,1-3H3,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	860	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511610 (CHEMBL4475438) Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1cc(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)c(Cl)cn1 |r| Show InChI InChI=1S/C24H32ClN5O3/c1-15-13-29(14-16(2)33-15)22-11-19(18(25)12-26-22)27-17-6-7-20-21(10-17)30(23(31)28(20)5)9-8-24(3,4)32/h6-7,10-12,15-16,32H,8-9,13-14H2,1-5H3,(H,26,27)/t15-,16+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511631 (CHEMBL4457011) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CCC(CC3)C(F)(F)F)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C23H28ClF3N6O2/c1-22(2,35)8-11-33-18-12-15(4-5-17(18)31(3)21(33)34)29-19-16(24)13-28-20(30-19)32-9-6-14(7-10-32)23(25,26)27/h4-5,12-14,35H,6-11H2,1-3H3,(H,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	960	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511639 (CHEMBL4451202) Show SMILES Cn1c2ccc(Nc3ccncc3Cl)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C18H21ClN4O2/c1-18(2,25)7-9-23-16-10-12(4-5-15(16)22(3)17(23)24)21-14-6-8-20-11-13(14)19/h4-6,8,10-11,25H,7,9H2,1-3H3,(H,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	990	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511620 (CHEMBL4469177) Show SMILES Cn1c2ccc(Nc3nc(ncc3Cl)N3CCCCC3)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C22H29ClN6O2/c1-22(2,31)9-12-29-18-13-15(7-8-17(18)27(3)21(29)30)25-19-16(23)14-24-20(26-19)28-10-5-4-6-11-28/h7-8,13-14,31H,4-6,9-12H2,1-3H3,(H,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511635 (CHEMBL4531272) Show SMILES CN(C)c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C19H25ClN6O2/c1-19(2,28)8-9-26-15-10-12(6-7-14(15)25(5)18(26)27)22-16-13(20)11-21-17(23-16)24(3)4/h6-7,10-11,28H,8-9H2,1-5H3,(H,21,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511621 (CHEMBL4457356) Show SMILES Cc1nc(C)c(s1)-c1ncc(Cl)c(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)n1 Show InChI InChI=1S/C22H25ClN6O2S/c1-12-18(32-13(2)25-12)20-24-11-15(23)19(27-20)26-14-6-7-16-17(10-14)29(21(30)28(16)5)9-8-22(3,4)31/h6-7,10-11,31H,8-9H2,1-5H3,(H,24,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511616 (CHEMBL4576646) Show SMILES Cn1c2ccc(Nc3ccnc(Cl)c3Cl)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C18H20Cl2N4O2/c1-18(2,26)7-9-24-14-10-11(4-5-13(14)23(3)17(24)25)22-12-6-8-21-16(20)15(12)19/h4-6,8,10,26H,7,9H2,1-3H3,(H,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511638 (CHEMBL4550751) Show SMILES C[C@@H](O)CCn1c2cc(Nc3ccnc(Cl)c3C#N)ccc2n(C)c1=O |r| Show InChI InChI=1S/C18H18ClN5O2/c1-11(25)6-8-24-16-9-12(3-4-15(16)23(2)18(24)26)22-14-5-7-21-17(19)13(14)10-20/h3-5,7,9,11,25H,6,8H2,1-2H3,(H,21,22)/t11-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511640 (CHEMBL4556514) Show SMILES Cn1c2ccc(Nc3nc(Cl)ncc3Cl)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C17H19Cl2N5O2/c1-17(2,26)6-7-24-13-8-10(4-5-12(13)23(3)16(24)25)21-14-11(18)9-20-15(19)22-14/h4-5,8-9,26H,6-7H2,1-3H3,(H,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511617 (CHEMBL4456923) Show SMILES Cn1c2ccc(Nc3ncnc(Cl)c3Cl)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C17H19Cl2N5O2/c1-17(2,26)6-7-24-12-8-10(4-5-11(12)23(3)16(24)25)22-15-13(18)14(19)20-9-21-15/h4-5,8-9,26H,6-7H2,1-3H3,(H,20,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511608 (CHEMBL4554124) Show SMILES Cn1c2ccc(Nc3ncnc(Cl)c3C#N)cc2n(CCC(C)(C)O)c1=O Show InChI InChI=1S/C18H19ClN6O2/c1-18(2,27)6-7-25-14-8-11(4-5-13(14)24(3)17(25)26)23-16-12(9-20)15(19)21-10-22-16/h4-5,8,10,27H,6-7H2,1-3H3,(H,21,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511606 (CHEMBL4555389) Show SMILES CCC(Cn1c2cc(Nc3ccnc(Cl)c3C#N)ccc2n(C)c1=O)C#N Show InChI InChI=1S/C19H17ClN6O/c1-3-12(9-21)11-26-17-8-13(4-5-16(17)25(2)19(26)27)24-15-6-7-23-18(20)14(15)10-22/h4-8,12H,3,11H2,1-2H3,(H,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511612 (CHEMBL4542555) Show SMILES Cn1c2ccc(Nc3ccnc(Cl)c3C#N)cc2n(C)c1=O Show InChI InChI=1S/C15H12ClN5O/c1-20-12-4-3-9(7-13(12)21(2)15(20)22)19-11-5-6-18-14(16)10(11)8-17/h3-7H,1-2H3,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511626 (CHEMBL4560573) Show SMILES C[C@H]1C[C@@H](C)CN(C1)c1cc(Nc2ccc3n(C)c(=O)n(CCC(C)(C)O)c3c2)c(Cl)cn1 |r| Show InChI InChI=1S/C25H34ClN5O2/c1-16-10-17(2)15-30(14-16)23-12-20(19(26)13-27-23)28-18-6-7-21-22(11-18)31(24(32)29(21)5)9-8-25(3,4)33/h6-7,11-13,16-17,33H,8-10,14-15H2,1-5H3,(H,27,28)/t16-,17+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511615 (CHEMBL4521627) Show SMILES C[C@H](O)CCn1c2cc(Nc3ccnc(Cl)c3C#N)ccc2n(C)c1=O |r| Show InChI InChI=1S/C18H18ClN5O2/c1-11(25)6-8-24-16-9-12(3-4-15(16)23(2)18(24)26)22-14-5-7-21-17(19)13(14)10-20/h3-5,7,9,11,25H,6,8H2,1-2H3,(H,21,22)/t11-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511613 (CHEMBL4437454) Show SMILES CC[C@@H](O)Cn1c2cc(Nc3ccnc(Cl)c3C#N)ccc2n(C)c1=O |r| Show InChI InChI=1S/C18H18ClN5O2/c1-3-12(25)10-24-16-8-11(4-5-15(16)23(2)18(24)26)22-14-6-7-21-17(19)13(14)9-20/h4-8,12,25H,3,10H2,1-2H3,(H,21,22)/t12-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511650 (CHEMBL4550911) Show SMILES CC[C@H](O)Cn1c2cc(Nc3ccnc(Cl)c3C#N)ccc2n(C)c1=O |r| Show InChI InChI=1S/C18H18ClN5O2/c1-3-12(25)10-24-16-8-11(4-5-15(16)23(2)18(24)26)22-14-6-7-21-17(19)13(14)9-20/h4-8,12,25H,3,10H2,1-2H3,(H,21,22)/t12-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511634 (CHEMBL4525917) Show SMILES CCC(O)Cn1c2cc(Nc3ccnc(Cl)c3C#N)ccc2n(C)c1=O Show InChI InChI=1S/C18H18ClN5O2/c1-3-12(25)10-24-16-8-11(4-5-15(16)23(2)18(24)26)22-14-6-7-21-17(19)13(14)9-20/h4-8,12,25H,3,10H2,1-2H3,(H,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511614 (CHEMBL4473868) Show SMILES CCCCn1c2cc(Nc3ccnc(Cl)c3C#N)ccc2n(C)c1=O Show InChI InChI=1S/C18H18ClN5O/c1-3-4-9-24-16-10-12(5-6-15(16)23(2)18(24)25)22-14-7-8-21-17(19)13(14)11-20/h5-8,10H,3-4,9H2,1-2H3,(H,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant His-tagged human BCL6 expressed in Escherichia coli BL21 AI cell incubated for 2 hrs by TR-FRET assay				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair
DNA topoisomerase 4 subunit A (Staphylococcus aureus)	BDBM50475221 (CHEMBL187677) Show SMILES O.O.O.O.N[C@@H](CCCNC(N)=N)C(O)=O.C[C@H]1CCc2c(N3CCC(O)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O |r| Show InChI InChI=1S/C19H21FN2O4.C6H14N4O2.4H2O/c1-10-2-3-12-16-13(18(24)14(19(25)26)9-22(10)16)8-15(20)17(12)21-6-4-11(23)5-7-21;7-4(5(11)12)2-1-3-10-6(8)9;;;;/h8-11,23H,2-7H2,1H3,(H,25,26);4H,1-3,7H2,(H,11,12)(H4,8,9,10);4*1H2/t10-;4-;;;;/m00..../s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wockhardt Limited Curated by ChEMBL					Assay Description Inhibition of supercoiling activity of topoisomerase IV from Staphylococcus aureus ISP 794				J Med Chem 48: 5232-42 (2005) Article DOI: 10.1021/jm050035f BindingDB Entry DOI: 10.7270/Q2K0771W
					More data for this Ligand-Target Pair
DNA gyrase subunit B (Staphylococcus aureus subsp. aureus Mu50)	BDBM50475221 (CHEMBL187677) Show SMILES O.O.O.O.N[C@@H](CCCNC(N)=N)C(O)=O.C[C@H]1CCc2c(N3CCC(O)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O |r| Show InChI InChI=1S/C19H21FN2O4.C6H14N4O2.4H2O/c1-10-2-3-12-16-13(18(24)14(19(25)26)9-22(10)16)8-15(20)17(12)21-6-4-11(23)5-7-21;7-4(5(11)12)2-1-3-10-6(8)9;;;;/h8-11,23H,2-7H2,1H3,(H,25,26);4H,1-3,7H2,(H,11,12)(H4,8,9,10);4*1H2/t10-;4-;;;;/m00..../s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wockhardt Limited Curated by ChEMBL					Assay Description Inhibition of supercoiling activity of DNA gyrase from Staphylococcus aureus ISP 794; Range = 2.5-5 ug/mL				J Med Chem 48: 5232-42 (2005) Article DOI: 10.1021/jm050035f BindingDB Entry DOI: 10.7270/Q2K0771W
					More data for this Ligand-Target Pair
B-cell lymphoma 6 protein (Homo sapiens)	BDBM50511612 (CHEMBL4542555) Show SMILES Cn1c2ccc(Nc3ccnc(Cl)c3C#N)cc2n(C)c1=O Show InChI InChI=1S/C15H12ClN5O/c1-20-12-4-3-9(7-13(12)21(2)15(20)22)19-11-5-6-18-14(16)10(11)8-17/h3-7H,1-2H3,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	1.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of Alexa Fluor 633 C5 maleimide-tagged BCOR from recombinant His-tagged human BCL6 (5 to 129 residues) expressed in Escherichia coli BL2...				J Med Chem 63: 4047-4068 (2020) Article DOI: 10.1021/acs.jmedchem.9b02076 BindingDB Entry DOI: 10.7270/Q2DF6VK2
					More data for this Ligand-Target Pair				3D Structure (crystal)
DNA gyrase subunit A/B (Staphylococcus aureus subsp. aureus Mu50)	BDBM21690 (1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,...) Show SMILES OC(=O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O Show InChI InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wockhardt Limited Curated by ChEMBL					Assay Description Inhibition of supercoiling activity of DNA gyrase from Staphylococcus aureus ISP 794				J Med Chem 48: 5232-42 (2005) Article DOI: 10.1021/jm050035f BindingDB Entry DOI: 10.7270/Q2K0771W
					More data for this Ligand-Target Pair				3D Structure (crystal)
DNA topoisomerase 4 subunit A (Staphylococcus aureus)	BDBM21690 (1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,...) Show SMILES OC(=O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O Show InChI InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wockhardt Limited Curated by ChEMBL					Assay Description Inhibition of supercoiling activity of topoisomerase IV from Staphylococcus aureus ISP 794; Range = 2.5-5 ug/mL				J Med Chem 48: 5232-42 (2005) Article DOI: 10.1021/jm050035f BindingDB Entry DOI: 10.7270/Q2K0771W
					More data for this Ligand-Target Pair
DNA topoisomerase 4 subunit A (Staphylococcus aureus)	BDBM50475222 (CHEBI:31889 | Nadifloxacin | OPC 7251 | OPC-7251) Show SMILES CC1CCc2c(N3CCC(O)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O Show InChI InChI=1S/C19H21FN2O4/c1-10-2-3-12-16-13(18(24)14(19(25)26)9-22(10)16)8-15(20)17(12)21-6-4-11(23)5-7-21/h8-11,23H,2-7H2,1H3,(H,25,26)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wockhardt Limited Curated by ChEMBL					Assay Description Inhibition of supercoiling activity of topoisomerase IV from Staphylococcus aureus ISP 794				J Med Chem 48: 5232-42 (2005) Article DOI: 10.1021/jm050035f BindingDB Entry DOI: 10.7270/Q2K0771W
					More data for this Ligand-Target Pair
DNA gyrase subunit B (Staphylococcus aureus subsp. aureus Mu50)	BDBM50475222 (CHEBI:31889 | Nadifloxacin | OPC 7251 | OPC-7251) Show SMILES CC1CCc2c(N3CCC(O)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O Show InChI InChI=1S/C19H21FN2O4/c1-10-2-3-12-16-13(18(24)14(19(25)26)9-22(10)16)8-15(20)17(12)21-6-4-11(23)5-7-21/h8-11,23H,2-7H2,1H3,(H,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wockhardt Limited Curated by ChEMBL					Assay Description Inhibition of supercoiling activity of DNA gyrase from Staphylococcus aureus ISP 794				J Med Chem 48: 5232-42 (2005) Article DOI: 10.1021/jm050035f BindingDB Entry DOI: 10.7270/Q2K0771W
					More data for this Ligand-Target Pair

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