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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Methylosome protein 50/Protein arginine N-methyltransferase 5' and Ligand = 'BDBM50529897'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Methylosome protein 50/Protein arginine N-methyltransferase 5


(Homo sapiens (Human))
BDBM50529897
PNG
(CHEMBL4468383)
Show SMILES O[C@@H](CNC(=O)c1ccc2CN(CCc2c1)C(=O)c1ccc(Br)cc1)CN1CCc2ccccc2C1 |r|
Show InChI InChI=1S/C29H30BrN3O3/c30-26-9-7-21(8-10-26)29(36)33-14-12-22-15-23(5-6-25(22)18-33)28(35)31-16-27(34)19-32-13-11-20-3-1-2-4-24(20)17-32/h1-10,15,27,34H,11-14,16-19H2,(H,31,35)/t27-/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.5n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

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 H...


Eur J Med Chem 164: 317-333 (2019)


Article DOI: 10.1016/j.ejmech.2018.12.065
BindingDB Entry DOI: 10.7270/Q2RR22Q1
More data for this
Ligand-Target Pair
Methylosome protein 50/Protein arginine N-methyltransferase 5


(Homo sapiens (Human))
BDBM50529897
PNG
(CHEMBL4468383)
Show SMILES O[C@@H](CNC(=O)c1ccc2CN(CCc2c1)C(=O)c1ccc(Br)cc1)CN1CCc2ccccc2C1 |r|
Show InChI InChI=1S/C29H30BrN3O3/c30-26-9-7-21(8-10-26)29(36)33-14-12-22-15-23(5-6-25(22)18-33)28(35)31-16-27(34)19-32-13-11-20-3-1-2-4-24(20)17-32/h1-10,15,27,34H,11-14,16-19H2,(H,31,35)/t27-/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.5n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

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 H...


Eur J Med Chem 164: 317-333 (2019)


Article DOI: 10.1016/j.ejmech.2018.12.065
BindingDB Entry DOI: 10.7270/Q2RR22Q1
More data for this
Ligand-Target Pair