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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone-arginine methyltransferase CARM1' and Ligand = 'BDBM50532858'   
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
Histone-arginine methyltransferase CARM1


(Homo sapiens (Human))
BDBM50532858
PNG
(CHEMBL4438506)
Show SMILES Cl.C[C@H](N)C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1 |r|
Show InChI InChI=1S/C16H16F2N2O2.ClH/c1-10(19)16(21)20-9-11-6-7-15(13(18)8-11)22-14-5-3-2-4-12(14)17;/h2-8,10H,9,19H2,1H3,(H,20,21);1H/t10-;/m0./s1
PDB

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 240n/an/an/an/an/an/a



University of Toronto

Curated by ChEMBL


Assay Description
Inhibition of full-length Halo-tagged human CARM1 (1 to 608 residues) expressed in 293-F cells using [3H]-SAM and biotinylated histone peptides by sc...


J Med Chem 59: 6838-47 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00668
BindingDB Entry DOI: 10.7270/Q2445QZC
More data for this
Ligand-Target Pair
Histone-arginine methyltransferase CARM1


(Homo sapiens (Human))
BDBM50532858
PNG
(CHEMBL4438506)
Show SMILES Cl.C[C@H](N)C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1 |r|
Show InChI InChI=1S/C16H16F2N2O2.ClH/c1-10(19)16(21)20-9-11-6-7-15(13(18)8-11)22-14-5-3-2-4-12(14)17;/h2-8,10H,9,19H2,1H3,(H,20,21);1H/t10-;/m0./s1
PDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a 240n/an/an/an/an/an/a



University of Toronto

Curated by ChEMBL


Assay Description
Inhibition of full-length Halo-tagged human CARM1 (1 to 608 residues) expressed in 293-F cells using [3H]-SAM and biotinylated histone peptides by sc...


J Med Chem 59: 6838-47 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00668
BindingDB Entry DOI: 10.7270/Q2445QZC
More data for this
Ligand-Target Pair