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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'N-lysine methyltransferase SMYD2' and Ligand = 'BDBM378778'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
N-lysine methyltransferase SMYD2


(Homo sapiens (Human))
BDBM378778
PNG
(4-cyclopropyl-N-(1-isopropylazetidin-3-yl)picolina...)
Show SMILES CC(C)N1CC(C1)NC(=O)c1cc(ccn1)C1CC1
Show InChI InChI=1S/C15H21N3O/c1-10(2)18-8-13(9-18)17-15(19)14-7-12(5-6-16-14)11-3-4-11/h5-7,10-11,13H,3-4,8-9H2,1-2H3,(H,17,19)
PDB

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UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a 1.30E+3n/an/an/an/an/an/a



Epizyme Inc

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% Bovine Skin Gelatin, and 0.002% Tween20, prepared on...


US Patent US10266526 (2019)


BindingDB Entry DOI: 10.7270/Q2DJ5HX2
More data for this
Ligand-Target Pair