Found 12 hits Enz. Inhib. hit(s) with all data for entry = 50001192 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 |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM177922
(US10307413, Compound 337 | US10391089, Compound 16...)Show SMILES O[C@@H](CNC(=O)c1cc(NC2COC2)ncn1)CN1CCc2ccccc2C1 |r| Show InChI InChI=1S/C20H25N5O3/c26-17(10-25-6-5-14-3-1-2-4-15(14)9-25)8-21-20(27)18-7-19(23-13-22-18)24-16-11-28-12-16/h1-4,7,13,16-17,26H,5-6,8-12H2,(H,21,27)(H,22,23,24)/t17-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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MCE PC cid PC sid PDB UniChem
| PDB Article PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of full length recombinant human FLAG-tagged PRMT5/full length recombinant human His6-tagged MEP50 expressed in baculovirus infected Sf9 i... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50114642
(5-(4-chlorophenyl)-2-furaldehyde semicarbazone | C...)Show InChI InChI=1S/C12H10ClN3O2/c13-9-3-1-8(2-4-9)11-6-5-10(18-11)7-15-16-12(14)17/h1-7H,(H3,14,16,17) | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 570 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50009672
(AdoHcy | CHEMBL418052 | S-(5'-adenosyl)-L-homocyst...)Show SMILES N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O Show InChI InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50271661
(CHEMBL4128989)Show InChI InChI=1S/C26H25NO2/c28-25(22-12-5-2-6-13-22)18-27-17-24-23-14-8-7-11-21(23)15-16-26(24)29-19-20-9-3-1-4-10-20/h1-16,25,27-28H,17-19H2 | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50271657
(CHEMBL4128513)Show SMILES COc1ccc(cc1C)-c1csc(Nc2ccc(O)c(c2)C(O)=O)n1 Show InChI InChI=1S/C18H16N2O4S/c1-10-7-11(3-6-16(10)24-2)14-9-25-18(20-14)19-12-4-5-15(21)13(8-12)17(22)23/h3-9,21H,1-2H3,(H,19,20)(H,22,23) | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50271658
(CHEMBL4125893)Show InChI InChI=1S/C17H13FN2O3S/c1-9-6-10(2-4-13(9)18)14-8-24-17(20-14)19-11-3-5-15(21)12(7-11)16(22)23/h2-8,21H,1H3,(H,19,20)(H,22,23) | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50271660
(CHEMBL4128780)Show SMILES Cc1ccc(C)c(c1)-c1csc(Nc2ccc(O)c(c2)C(O)=O)n1 Show InChI InChI=1S/C18H16N2O3S/c1-10-3-4-11(2)13(7-10)15-9-24-18(20-15)19-12-5-6-16(21)14(8-12)17(22)23/h3-9,21H,1-2H3,(H,19,20)(H,22,23) | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50271659
(CHEMBL4127388)Show InChI InChI=1S/C15H23N3O4/c1-4-17(5-2)10-6-9-16-15(19)12-7-8-14(22-3)13(11-12)18(20)21/h7-8,11H,4-6,9-10H2,1-3H3,(H,16,19) | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50271655
(CHEMBL4127276)Show SMILES OC(=O)COc1ccc(Br)cc1-c1csc(Nc2ccc(Br)cc2)n1 Show InChI InChI=1S/C17H12Br2N2O3S/c18-10-1-4-12(5-2-10)20-17-21-14(9-25-17)13-7-11(19)3-6-15(13)24-8-16(22)23/h1-7,9H,8H2,(H,20,21)(H,22,23) | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Methylosome protein 50/Protein arginine N-methyltransferase 5
(Homo sapiens (Human)) | BDBM50271656
(CHEMBL4127123)Show SMILES COc1cc(Br)c(Br)c(\C=N\c2cccc(c2)-c2nc3ccccc3[nH]2)c1O Show InChI InChI=1S/C21H15Br2N3O2/c1-28-18-10-15(22)19(23)14(20(18)27)11-24-13-6-4-5-12(9-13)21-25-16-7-2-3-8-17(16)26-21/h2-11,27H,1H3,(H,25,26)/b24-11+ | PDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged PRMT5 (2 to end residues) /human N-terminal His-tagged MEP50 (2 to end residues) expressed in ... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Protein arginine N-methyltransferase 1
(Homo sapiens) | BDBM50271657
(CHEMBL4128513)Show SMILES COc1ccc(cc1C)-c1csc(Nc2ccc(O)c(c2)C(O)=O)n1 Show InChI InChI=1S/C18H16N2O4S/c1-10-7-11(3-6-16(10)24-2)14-9-25-18(20-14)19-12-4-5-15(21)13(8-12)17(22)23/h3-9,21H,1-2H3,(H,19,20)(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
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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 |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal GST-tagged PRMT1 (2 to end residues) expressed in baculovirus infected Sf9 insect cells using peptide subs... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |
Histone-arginine methyltransferase CARM1
(Homo sapiens (Human)) | BDBM50271657
(CHEMBL4128513)Show SMILES COc1ccc(cc1C)-c1csc(Nc2ccc(O)c(c2)C(O)=O)n1 Show InChI InChI=1S/C18H16N2O4S/c1-10-7-11(3-6-16(10)24-2)14-9-25-18(20-14)19-12-4-5-15(21)13(8-12)17(22)23/h3-9,21H,1-2H3,(H,19,20)(H,22,23) | PDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
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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 |
University of Jinan
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal FLAG-tagged CARM1 (2 to end residues) expressed in HEK293F cells pretreated for 15 mins followed by substr... |
Bioorg Med Chem Lett 28: 1476-1483 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.087 BindingDB Entry DOI: 10.7270/Q2CN76D3 |
More data for this Ligand-Target Pair | |