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Target
Histone-lysine N-methyltransferase EZH2
Ligand
BDBM310767
Substrate
n/a
Meas. Tech.
Wild-Type PRC2 Enzyme Assay
IC50
367±n/a nM
Citation
 Campbell, JE Substituted benzene compounds US Patent  US10150764 Publication Date 12/11/2018 
Target
Name:
Histone-lysine N-methyltransferase EZH2
Synonyms:
ENX-1 | EZH2 | EZH2_HUMAN | Enhancer of zeste homolog 2 (EZH2) | Histone-lysine N-methyltransferase EZH2 | KMT6 | Lysine N-methyltransferase 6
Type:
Protein
Mol. Mass.:
85367.84
Organism:
Homo sapiens (Human)
Description:
Q15910
Residue:
746
Sequence:
MGQTGKKSEKGPVCWRKRVKSEYMRLRQLKRFRRADEVKSMFSSNRQKILERTEILNQEWKQRRIQPVHILTSVSSLRGTRECSVTSDLDFPTQVIPLKTLNAVASVPIMYSWSPLQQNFMVEDETVLHNIPYMGDEVLDQDGTFIEELIKNYDGKVHGDRECGFINDEIFVELVNALGQYNDDDDDDDGDDPEEREEKQKDLEDHRDDKESRPPRKFPSDKIFEAISSMFPDKGTAEELKEKYKELTEQQLPGALPPECTPNIDGPNAKSVQREQSLHSFHTLFCRRCFKYDCFLHPFHATPNTYKRKNTETALDNKPCGPQCYQHLEGAKEFAAALTAERIKTPPKRPGGRRRGRLPNNSSRPSTPTINVLESKDTDSDREAGTETGGENNDKEEEEKKDETSSSSEANSRCQTPIKMKPNIEPPENVEWSGAEASMFRVLIGTYYDNFCAIARLIGTKTCRQVYEFRVKESSIIAPAPAEDVDTPPRKKKRKHRLWAAHCRKIQLKKDGSSNHVYNYQPCDHPRQPCDSSCPCVIAQNFCEKFCQCSSECQNRFPGCRCKAQCNTKQCPCYLAVRECDPDLCLTCGAADHWDSKNVSCKNCSIQRGSKKHLLLAPSDVAGWGIFIKDPVQKNEFISEYCGEIISQDEADRRGKVYDKYMCSFLFNLNNDFVVDATRKGNKIRFANHSVNPNCYAKVMMVNGDHRIGIFAKRAIQTGEELFFDYRYSQADALKYVGIEREMEIP
  
Inhibitor
Name:
BDBM310767
Synonyms:
US10150764, Compound 52
Type:
Small organic molecule
Emp. Form.:
C25H38ClN5O2
Mol. Mass.:
476.055
SMILES:
CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(-4,2.66,;-2.67,1.89,;-1.33,2.66,;-1.33,4.2,;,4.97,;,6.51,;-1.33,7.28,;-2.67,6.51,;-2.67,4.97,;-1.33,8.82,;,9.59,;-2.67,9.59,;,1.89,;1.33,2.66,;2.67,1.89,;4,2.66,;2.67,.35,;1.33,-.42,;1.33,-1.96,;2.67,-2.73,;,-2.73,;,-4.27,;-1.33,-5.04,;-1.33,-6.58,;,-7.35,;-2.8,-7.05,;-3.12,-8.56,;-1.97,-9.59,;-3.7,-5.81,;-2.8,-4.56,;-3.57,-3.23,;,.35,;-1.33,-.42,)|
Structure:
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