Found 78 hits Enz. Inhib. hit(s) with all data for entry = 50047098 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 |
Peregrin
(Homo sapiens (Human)) | BDBM50148463
(CHEMBL3770971)Show SMILES Cn1c2ccc(NS(=O)(=O)c3ccc4OCCCc4c3)cc2n(C)c1=O Show InChI InChI=1S/C18H19N3O4S/c1-20-15-7-5-13(11-16(15)21(2)18(20)22)19-26(23,24)14-6-8-17-12(10-14)4-3-9-25-17/h5-8,10-11,19H,3-4,9H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148549
(4-Bromo-N-(2,3-dihydro-6-methoxy-1,3-dimethyl-2-ox...)Show SMILES COc1cc2n(C)c(=O)n(C)c2cc1NS(=O)(=O)c1ccc(Br)cc1C Show InChI InChI=1S/C17H18BrN3O4S/c1-10-7-11(18)5-6-16(10)26(23,24)19-12-8-13-14(9-15(12)25-4)21(3)17(22)20(13)2/h5-9,19H,1-4H3 | PDB
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CHEMBL MCE PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Peregrin
(Homo sapiens (Human)) | BDBM50148467
(CHEMBL3770004)Show SMILES Cn1c2cc(NS(=O)(=O)c3ccc(Cl)cc3)c(Oc3ccccc3)cc2n(C)c1=O Show InChI InChI=1S/C21H18ClN3O4S/c1-24-18-12-17(23-30(27,28)16-10-8-14(22)9-11-16)20(13-19(18)25(2)21(24)26)29-15-6-4-3-5-7-15/h3-13,23H,1-2H3 | PDB
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148465
(CHEMBL3771151)Show SMILES Cn1c2ccc(NS(=O)(=O)c3ccc4CCCc4c3)cc2n(C)c1=O Show InChI InChI=1S/C18H19N3O3S/c1-20-16-9-7-14(11-17(16)21(2)18(20)22)19-25(23,24)15-8-6-12-4-3-5-13(12)10-15/h6-11,19H,3-5H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148468
(CHEMBL3769887)Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C23H23N3O6S/c1-25-18-13-17(24-33(28,29)16-10-11-20(30-3)22(12-16)31-4)21(14-19(18)26(2)23(25)27)32-15-8-6-5-7-9-15/h5-14,24H,1-4H3 | PDB
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148464
(CHEMBL3771106)Show SMILES Cn1c2ccc(NS(=O)(=O)c3ccc4OC(C)(C)CCc4c3)cc2n(C)c1=O Show InChI InChI=1S/C20H23N3O4S/c1-20(2)10-9-13-11-15(6-8-18(13)27-20)28(25,26)21-14-5-7-16-17(12-14)23(4)19(24)22(16)3/h5-8,11-12,21H,9-10H2,1-4H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 310 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148460
(CHEMBL1346130)Show SMILES Cn1c2ccc(NS(=O)(=O)c3ccc4CCCCc4c3)cc2n(C)c1=O Show InChI InChI=1S/C19H21N3O3S/c1-21-17-10-8-15(12-18(17)22(2)19(21)23)20-26(24,25)16-9-7-13-5-3-4-6-14(13)11-16/h7-12,20H,3-6H2,1-2H3 | PDB
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148470
(CHEMBL3771002)Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-11-9-15(29-3)10-12-17)21(14-20(19)25(2)22(24)26)30-16-7-5-4-6-8-16/h4-14,23H,1-3H3 | PDB
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UniProtKB/SwissProt
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148478
(CHEMBL3769965 | US10702504, Compound A)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)cc1 Show InChI InChI=1S/C24H25N3O7S/c1-26-19-13-18(25-35(29,30)17-10-11-21(32-4)23(12-17)33-5)22(14-20(19)27(2)24(26)28)34-16-8-6-15(31-3)7-9-16/h6-14,25H,1-5H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148462
(CHEMBL3770886)Show SMILES CC(C)c1ccc(cc1)S(=O)(=O)Nc1ccc2n(C)c(=O)n(C)c2c1 Show InChI InChI=1S/C18H21N3O3S/c1-12(2)13-5-8-15(9-6-13)25(23,24)19-14-7-10-16-17(11-14)21(4)18(22)20(16)3/h5-12,19H,1-4H3 | PDB
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UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 420 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148475
(CHEMBL3770465)Show SMILES Cc1ccccc1S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O4S/c1-15-9-7-8-12-21(15)30(27,28)23-17-13-18-19(25(3)22(26)24(18)2)14-20(17)29-16-10-5-4-6-11-16/h4-14,23H,1-3H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 430 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148476
(CHEMBL3770391)Show SMILES COc1cccc(c1)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-11-7-10-16(12-17)29-3)21(14-20(19)25(2)22(24)26)30-15-8-5-4-6-9-15/h4-14,23H,1-3H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 430 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148478
(CHEMBL3769965 | US10702504, Compound A)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)cc1 Show InChI InChI=1S/C24H25N3O7S/c1-26-19-13-18(25-35(29,30)17-10-11-21(32-4)23(12-17)33-5)22(14-20(19)27(2)24(26)28)34-16-8-6-15(31-3)7-9-16/h6-14,25H,1-5H3 | PDB
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UniProtKB/SwissProt
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| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 430 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148468
(CHEMBL3769887)Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C23H23N3O6S/c1-25-18-13-17(24-33(28,29)16-10-11-20(30-3)22(12-16)31-4)21(14-19(18)26(2)23(25)27)32-15-8-6-5-7-9-15/h5-14,24H,1-4H3 | PDB
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 480 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148474
(CHEMBL3771226)Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O4S/c1-15-9-11-17(12-10-15)30(27,28)23-18-13-19-20(25(3)22(26)24(19)2)14-21(18)29-16-7-5-4-6-8-16/h4-14,23H,1-3H3 | PDB
KEGG
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 510 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148461
(CHEMBL3770652)Show SMILES Cc1ccc(cc1F)S(=O)(=O)Nc1ccc2n(C)c(=O)n(C)c2c1 Show InChI InChI=1S/C16H16FN3O3S/c1-10-4-6-12(9-13(10)17)24(22,23)18-11-5-7-14-15(8-11)20(3)16(21)19(14)2/h4-9,18H,1-3H3 | PDB
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UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148480
(CHEMBL3770456)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C23H23N3O6S/c1-25-20-13-19(24-33(28,29)18-11-9-16(31-4)10-12-18)22(14-21(20)26(2)23(25)27)32-17-7-5-15(30-3)6-8-17/h5-14,24H,1-4H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148479
(CHEMBL3770259)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-7-5-4-6-8-17)21(14-20(19)25(2)22(24)26)30-16-11-9-15(29-3)10-12-16/h4-14,23H,1-3H3 | PDB
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| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148481
(CHEMBL3771005)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccccc2C)cc1 Show InChI InChI=1S/C23H23N3O5S/c1-15-7-5-6-8-22(15)32(28,29)24-18-13-19-20(26(3)23(27)25(19)2)14-21(18)31-17-11-9-16(30-4)10-12-17/h5-14,24H,1-4H3 | PDB
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 680 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148479
(CHEMBL3770259)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-7-5-4-6-8-17)21(14-20(19)25(2)22(24)26)30-16-11-9-15(29-3)10-12-16/h4-14,23H,1-3H3 | PDB
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UniProtKB/SwissProt
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| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 730 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148470
(CHEMBL3771002)Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-11-9-15(29-3)10-12-17)21(14-20(19)25(2)22(24)26)30-16-7-5-4-6-8-16/h4-14,23H,1-3H3 | PDB
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UniProtKB/SwissProt
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148480
(CHEMBL3770456)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C23H23N3O6S/c1-25-20-13-19(24-33(28,29)18-11-9-16(31-4)10-12-18)22(14-21(20)26(2)23(25)27)32-17-7-5-15(30-3)6-8-17/h5-14,24H,1-4H3 | PDB
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GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 770 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148473
(CHEMBL3770048)Show SMILES Cc1ccc(F)cc1S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H20FN3O4S/c1-14-9-10-15(23)11-21(14)31(28,29)24-17-12-18-19(26(3)22(27)25(18)2)13-20(17)30-16-7-5-4-6-8-16/h4-13,24H,1-3H3 | PDB
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| Article PubMed
| n/a | n/a | 790 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148472
(CHEMBL3770861)Show SMILES Cc1ccc(cc1F)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H20FN3O4S/c1-14-9-10-16(11-17(14)23)31(28,29)24-18-12-19-20(26(3)22(27)25(19)2)13-21(18)30-15-7-5-4-6-8-15/h4-13,24H,1-3H3 | PDB
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UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.05E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148471
(CHEMBL3771154)Show SMILES Cc1cc(Cl)ccc1S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H20ClN3O4S/c1-14-11-15(23)9-10-21(14)31(28,29)24-17-12-18-19(26(3)22(27)25(18)2)13-20(17)30-16-7-5-4-6-8-16/h4-13,24H,1-3H3 | PDB
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CHEMBL PC cid PC sid UniChem
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| Article PubMed
| n/a | n/a | 1.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148549
(4-Bromo-N-(2,3-dihydro-6-methoxy-1,3-dimethyl-2-ox...)Show SMILES COc1cc2n(C)c(=O)n(C)c2cc1NS(=O)(=O)c1ccc(Br)cc1C Show InChI InChI=1S/C17H18BrN3O4S/c1-10-7-11(18)5-6-16(10)26(23,24)19-12-8-13-14(9-15(12)25-4)21(3)17(22)20(13)2/h5-9,19H,1-4H3 | PDB
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CHEMBL MCE PC cid PC sid PDB UniChem
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| PDB Article PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148468
(CHEMBL3769887)Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C23H23N3O6S/c1-25-18-13-17(24-33(28,29)16-10-11-20(30-3)22(12-16)31-4)21(14-19(18)26(2)23(25)27)32-15-8-6-5-7-9-15/h5-14,24H,1-4H3 | PDB
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CHEMBL PC cid PC sid UniChem
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| Article PubMed
| n/a | n/a | 1.21E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148474
(CHEMBL3771226)Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O4S/c1-15-9-11-17(12-10-15)30(27,28)23-18-13-19-20(25(3)22(26)24(19)2)14-21(18)29-16-7-5-4-6-8-16/h4-14,23H,1-3H3 | PDB
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| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148470
(CHEMBL3771002)Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-11-9-15(29-3)10-12-17)21(14-20(19)25(2)22(24)26)30-16-7-5-4-6-8-16/h4-14,23H,1-3H3 | PDB
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148466
(CHEMBL3771239)Show SMILES CO[C@@]1(C)Oc2ccc(cc2OC1(C)OC)S(=O)(=O)Nc1ccc2n(C)c(=O)n(C)c2c1 |r| Show InChI InChI=1S/C21H25N3O7S/c1-20(28-5)21(2,29-6)31-18-12-14(8-10-17(18)30-20)32(26,27)22-13-7-9-15-16(11-13)24(4)19(25)23(15)3/h7-12,22H,1-6H3/t20-,21?/m0/s1 | PDB
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| 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 |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148481
(CHEMBL3771005)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccccc2C)cc1 Show InChI InChI=1S/C23H23N3O5S/c1-15-7-5-6-8-22(15)32(28,29)24-18-13-19-20(26(3)23(27)25(19)2)14-21(18)31-17-11-9-16(30-4)10-12-17/h5-14,24H,1-4H3 | PDB
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| Article PubMed
| n/a | n/a | 1.47E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148467
(CHEMBL3770004)Show SMILES Cn1c2cc(NS(=O)(=O)c3ccc(Cl)cc3)c(Oc3ccccc3)cc2n(C)c1=O Show InChI InChI=1S/C21H18ClN3O4S/c1-24-18-12-17(23-30(27,28)16-10-8-14(22)9-11-16)20(13-19(18)25(2)21(24)26)29-15-6-4-3-5-7-15/h3-13,23H,1-2H3 | PDB
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CHEMBL PC cid PC sid UniChem
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| Article PubMed
| n/a | n/a | 1.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148463
(CHEMBL3770971)Show SMILES Cn1c2ccc(NS(=O)(=O)c3ccc4OCCCc4c3)cc2n(C)c1=O Show InChI InChI=1S/C18H19N3O4S/c1-20-15-7-5-13(11-16(15)21(2)18(20)22)19-26(23,24)14-6-8-17-12(10-14)4-3-9-25-17/h5-8,10-11,19H,3-4,9H2,1-2H3 | PDB
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| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148475
(CHEMBL3770465)Show SMILES Cc1ccccc1S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O4S/c1-15-9-7-8-12-21(15)30(27,28)23-17-13-18-19(25(3)22(26)24(18)2)14-20(17)29-16-10-5-4-6-11-16/h4-14,23H,1-3H3 | PDB
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| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148465
(CHEMBL3771151)Show SMILES Cn1c2ccc(NS(=O)(=O)c3ccc4CCCc4c3)cc2n(C)c1=O Show InChI InChI=1S/C18H19N3O3S/c1-20-16-9-7-14(11-17(16)21(2)18(20)22)19-25(23,24)15-8-6-12-4-3-5-13(12)10-15/h6-11,19H,3-5H2,1-2H3 | PDB
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| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148478
(CHEMBL3769965 | US10702504, Compound A)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccc(OC)c(OC)c2)cc1 Show InChI InChI=1S/C24H25N3O7S/c1-26-19-13-18(25-35(29,30)17-10-11-21(32-4)23(12-17)33-5)22(14-20(19)27(2)24(26)28)34-16-8-6-15(31-3)7-9-16/h6-14,25H,1-5H3 | PDB
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| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 1.75E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148476
(CHEMBL3770391)Show SMILES COc1cccc(c1)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-11-7-10-16(12-17)29-3)21(14-20(19)25(2)22(24)26)30-15-8-5-4-6-9-15/h4-14,23H,1-3H3 | PDB
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| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.99E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148460
(CHEMBL1346130)Show SMILES Cn1c2ccc(NS(=O)(=O)c3ccc4CCCCc4c3)cc2n(C)c1=O Show InChI InChI=1S/C19H21N3O3S/c1-21-17-10-8-15(12-18(17)22(2)19(21)23)20-26(24,25)16-9-7-13-5-3-4-6-14(13)11-16/h7-12,20H,3-6H2,1-2H3 | PDB
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CHEMBL PC cid PC sid UniChem
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| Article PubMed
| n/a | n/a | 2.05E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148548
(CHEMBL3770384)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccc(C)cc2)cc1 Show InChI InChI=1S/C23H23N3O5S/c1-15-5-11-18(12-6-15)32(28,29)24-19-13-20-21(26(3)23(27)25(20)2)14-22(19)31-17-9-7-16(30-4)8-10-17/h5-14,24H,1-4H3 | PDB
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| Article PubMed
| n/a | n/a | 2.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148476
(CHEMBL3770391)Show SMILES COc1cccc(c1)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-11-7-10-16(12-17)29-3)21(14-20(19)25(2)22(24)26)30-15-8-5-4-6-9-15/h4-14,23H,1-3H3 | PDB
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| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.38E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148481
(CHEMBL3771005)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccccc2C)cc1 Show InChI InChI=1S/C23H23N3O5S/c1-15-7-5-6-8-22(15)32(28,29)24-18-13-19-20(26(3)23(27)25(19)2)14-21(18)31-17-11-9-16(30-4)10-12-17/h5-14,24H,1-4H3 | PDB
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.38E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148471
(CHEMBL3771154)Show SMILES Cc1cc(Cl)ccc1S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H20ClN3O4S/c1-14-11-15(23)9-10-21(14)31(28,29)24-17-12-18-19(26(3)22(27)25(18)2)13-20(17)30-16-7-5-4-6-8-16/h4-13,24H,1-3H3 | PDB
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148473
(CHEMBL3770048)Show SMILES Cc1ccc(F)cc1S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H20FN3O4S/c1-14-9-10-15(23)11-21(14)31(28,29)24-17-12-18-19(26(3)22(27)25(18)2)13-20(17)30-16-7-5-4-6-8-16/h4-13,24H,1-3H3 | PDB
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UniProtKB/SwissProt
GoogleScholar AffyNet
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.42E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148471
(CHEMBL3771154)Show SMILES Cc1cc(Cl)ccc1S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H20ClN3O4S/c1-14-11-15(23)9-10-21(14)31(28,29)24-17-12-18-19(26(3)22(27)25(18)2)13-20(17)30-16-7-5-4-6-8-16/h4-13,24H,1-3H3 | PDB
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UniProtKB/SwissProt
GoogleScholar AffyNet
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.45E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148464
(CHEMBL3771106)Show SMILES Cn1c2ccc(NS(=O)(=O)c3ccc4OC(C)(C)CCc4c3)cc2n(C)c1=O Show InChI InChI=1S/C20H23N3O4S/c1-20(2)10-9-13-11-15(6-8-18(13)27-20)28(25,26)21-14-5-7-16-17(12-14)23(4)19(24)22(16)3/h5-8,11-12,21H,9-10H2,1-4H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148475
(CHEMBL3770465)Show SMILES Cc1ccccc1S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H21N3O4S/c1-15-9-7-8-12-21(15)30(27,28)23-17-13-18-19(25(3)22(26)24(18)2)14-20(17)29-16-10-5-4-6-11-16/h4-14,23H,1-3H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Bromodomain-containing protein 1
(Homo sapiens (Human)) | BDBM50148477
(CHEMBL3771230)Show SMILES Cn1c2cc(NS(=O)(=O)c3ccc4CCCCc4c3)c(Oc3ccccc3)cc2n(C)c1=O Show InChI InChI=1S/C25H25N3O4S/c1-27-22-15-21(26-33(30,31)20-13-12-17-8-6-7-9-18(17)14-20)24(16-23(22)28(2)25(27)29)32-19-10-4-3-5-11-19/h3-5,10-16,26H,6-9H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.67E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF2 BRD1 (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Peregrin
(Homo sapiens (Human)) | BDBM50148477
(CHEMBL3771230)Show SMILES Cn1c2cc(NS(=O)(=O)c3ccc4CCCCc4c3)c(Oc3ccccc3)cc2n(C)c1=O Show InChI InChI=1S/C25H25N3O4S/c1-27-22-15-21(26-33(30,31)20-13-12-17-8-6-7-9-18(17)14-20)24(16-23(22)28(2)25(27)29)32-19-10-4-3-5-11-19/h3-5,10-16,26H,6-9H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.68E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of BRPF1B (unknown origin) by Alpha Screen assay |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148472
(CHEMBL3770861)Show SMILES Cc1ccc(cc1F)S(=O)(=O)Nc1cc2n(C)c(=O)n(C)c2cc1Oc1ccccc1 Show InChI InChI=1S/C22H20FN3O4S/c1-14-9-10-16(11-17(14)23)31(28,29)24-18-12-19-20(26(3)22(27)25(19)2)13-21(18)30-15-7-5-4-6-8-15/h4-13,24H,1-3H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |
Transcription intermediary factor 1-alpha
(Homo sapiens (Human)) | BDBM50148548
(CHEMBL3770384)Show SMILES COc1ccc(Oc2cc3n(C)c(=O)n(C)c3cc2NS(=O)(=O)c2ccc(C)cc2)cc1 Show InChI InChI=1S/C23H23N3O5S/c1-15-5-11-18(12-6-15)32(28,29)24-19-13-20-21(26(3)23(27)25(20)2)14-22(19)31-17-9-7-16(30-4)8-10-17/h5-14,24H,1-4H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oxford
Curated by ChEMBL
| Assay Description Inhibition of N-terminal His6-SUMO-1-tagged recombinant human TRIM24 bromodomain expressed in Escherichia coli BL21(DE3)-R3-pRARE2 cells by Alpha Scr... |
J Med Chem 59: 1642-7 (2016)
Article DOI: 10.1021/acs.jmedchem.5b00458 BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | |