Found 13 hits for monomerid = 50148549 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
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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| PDB Article PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | 7.4 | 25 |
Oxford University
| Assay Description Assays were performed as described previously with minor modifications(Philpott et al., 2011). All reagents were diluted in 25 mM HEPES, 100 mM NaCl,... |
ACS Chem Biol 12: 2619-2630 (2017)
Article DOI: 10.1021/acschembio.7b00481 BindingDB Entry DOI: 10.7270/Q2HM56MX |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Bromodomain-containing protein 4
(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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B.MOAD antibodypedia GoogleScholar AffyNet
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | 7.4 | 25 |
Oxford University
| Assay Description Assays were performed as described previously with minor modifications(Philpott et al., 2011). All reagents were diluted in 25 mM HEPES, 100 mM NaCl,... |
ACS Chem Biol 12: 2619-2630 (2017)
Article DOI: 10.1021/acschembio.7b00481 BindingDB Entry DOI: 10.7270/Q2HM56MX |
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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| PDB Article PubMed
| n/a | n/a | 270 | n/a | n/a | n/a | n/a | 7.4 | 25 |
Oxford University
| Assay Description Assays were performed as described previously with minor modifications(Philpott et al., 2011). All reagents were diluted in 25 mM HEPES, 100 mM NaCl,... |
ACS Chem Biol 12: 2619-2630 (2017)
Article DOI: 10.1021/acschembio.7b00481 BindingDB Entry DOI: 10.7270/Q2HM56MX |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Transcription intermediary factor 1-alpha
(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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| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | 7.4 | 25 |
Oxford University
| Assay Description Assays were performed as described previously with minor modifications(Philpott et al., 2011). All reagents were diluted in 25 mM HEPES, 100 mM NaCl,... |
ACS Chem Biol 12: 2619-2630 (2017)
Article DOI: 10.1021/acschembio.7b00481 BindingDB Entry DOI: 10.7270/Q2HM56MX |
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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| PDB 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)
BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
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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| 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)
BindingDB Entry DOI: 10.7270/Q2JS9S9G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
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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| n/a | n/a | 282 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer AG
Curated by ChEMBL
| |
J Med Chem 60: 4002-4022 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00306 BindingDB Entry DOI: 10.7270/Q2XG9TKS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Bromodomain and PHD finger-containing protein 3
(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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| n/a | n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description Binding affinity to BRPF3 (unknown origin) by isothermal titration calorimetric analysis |
J Med Chem 59: 1271-98 (2016)
BindingDB Entry DOI: 10.7270/Q2X92D6H |
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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| PDB PubMed
| n/a | n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description Binding affinity to BRPF2 (unknown origin) by isothermal titration calorimetric analysis |
J Med Chem 59: 1271-98 (2016)
BindingDB Entry DOI: 10.7270/Q2X92D6H |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
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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| PDB Article PubMed
| n/a | n/a | 1.68E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer AG
Curated by ChEMBL
| |
J Med Chem 60: 4002-4022 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00306 BindingDB Entry DOI: 10.7270/Q2XG9TKS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
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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| n/a | n/a | 128 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer AG
Curated by ChEMBL
| |
J Med Chem 60: 4002-4022 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00306 BindingDB Entry DOI: 10.7270/Q2XG9TKS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
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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| n/a | n/a | 383 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer AG
Curated by ChEMBL
| |
J Med Chem 60: 4002-4022 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00306 BindingDB Entry DOI: 10.7270/Q2XG9TKS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
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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UniProtKB/SwissProt
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CHEMBL MCE PC cid PC sid PDB UniChem
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| PDB PubMed
| n/a | n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description Binding affinity to BRPF1B (unknown origin) by isothermal titration calorimetric analysis |
J Med Chem 59: 1271-98 (2016)
BindingDB Entry DOI: 10.7270/Q2X92D6H |
More data for this Ligand-Target Pair | 3D Structure (crystal) |