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Target
Histone-lysine N-methyltransferase EZH2 [Y641F]
Ligand
BDBM310753
Substrate
n/a
Meas. Tech.
Wild-Type PRC2 Enzyme Assay
IC50
265±n/a nM
Citation
 Campbell, JE Substituted benzene compounds US Patent  US10150764 Publication Date 12/11/2018 
Target
Name:
Histone-lysine N-methyltransferase EZH2 [Y641F]
Synonyms:
EZH2 | EZH2(Y641F) | EZH2_HUMAN | Histone-lysine N-methyltransferase EZH2 (Y641F) | KMT6
Type:
n/a
Mol. Mass.:
85351.84
Organism:
Homo sapiens (Human)
Description:
Q15910[Y641F]
Residue:
746
Sequence:
MGQTGKKSEKGPVCWRKRVKSEYMRLRQLKRFRRADEVKSMFSSNRQKILERTEILNQEWKQRRIQPVHILTSVSSLRGTRECSVTSDLDFPTQVIPLKTLNAVASVPIMYSWSPLQQNFMVEDETVLHNIPYMGDEVLDQDGTFIEELIKNYDGKVHGDRECGFINDEIFVELVNALGQYNDDDDDDDGDDPEEREEKQKDLEDHRDDKESRPPRKFPSDKIFEAISSMFPDKGTAEELKEKYKELTEQQLPGALPPECTPNIDGPNAKSVQREQSLHSFHTLFCRRCFKYDCFLHPFHATPNTYKRKNTETALDNKPCGPQCYQHLEGAKEFAAALTAERIKTPPKRPGGRRRGRLPNNSSRPSTPTINVLESKDTDSDREAGTETGGENNDKEEEEKKDETSSSSEANSRCQTPIKMKPNIEPPENVEWSGAEASMFRVLIGTYYDNFCAIARLIGTKTCRQVYEFRVKESSIIAPAPAEDVDTPPRKKKRKHRLWAAHCRKIQLKKDGSSNHVYNYQPCDHPRQPCDSSCPCVIAQNFCEKFCQCSSECQNRFPGCRCKAQCNTKQCPCYLAVRECDPDLCLTCGAADHWDSKNVSCKNCSIQRGSKKHLLLAPSDVAGWGIFIKDPVQKNEFISEFCGEIISQDEADRRGKVYDKYMCSFLFNLNNDFVVDATRKGNKIRFANHSVNPNCYAKVMMVNGDHRIGIFAKRAIQTGEELFFDYRYSQADALKYVGIEREMEIP
  
Inhibitor
Name:
BDBM310753
Synonyms:
US10150764, Compound 38
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(CC)[nH]n(C)c2=O)c1C |r,wU:6.9,wD:3.2,(-3.41,1.7,;-2.07,.93,;-.74,1.7,;-.74,3.24,;.59,4.01,;.59,5.55,;-.74,6.32,;-2.07,5.55,;-2.07,4.01,;-.74,7.86,;.59,8.63,;-2.07,8.63,;.59,.93,;1.93,1.7,;3.26,.93,;4.6,1.7,;3.26,-.61,;1.93,-1.38,;1.93,-2.92,;3.26,-3.69,;.59,-3.69,;.59,-5.23,;-.74,-6,;-.74,-7.54,;.35,-8.63,;1.84,-8.23,;-2.2,-8.02,;-3.11,-6.77,;-4.6,-6.37,;-2.2,-5.52,;-2.97,-4.19,;.59,-.61,;-.74,-1.38,)|
Structure:
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