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Target
Histone-lysine N-methyltransferase EZH2 [Y641F]
Ligand
BDBM516872
Substrate
n/a
Meas. Tech.
In Vitro Methyltransferase Activity Assay
IC50
53.0±n/a nM
Citation
 Peng, J; Liu, Y; Wang, L; Fang, Z; Fei, Z; Chen, X; Lan, J 4,5,6-trisubstituted indazole derivatives, and preparation method and pharmaceutical use thereof US Patent  US11104664 Publication Date 8/31/2021 
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:
BDBM516872
Synonyms:
US11104664, Compound P-46
Type:
Small organic molecule
Emp. Form.:
C28H36N4O4
Mol. Mass.:
492.6098
SMILES:
CCN(C1CCC(C)(CC1)NC(=O)OCc1ccccc1)c1c(C)c(cc2n(C)ncc12)C(=O)OC |(2.23,-5.12,;2.23,-6.66,;.89,-7.43,;-.44,-6.66,;-1.78,-7.43,;-3.11,-6.66,;-3.11,-5.12,;-4.65,-5.06,;-1.78,-4.35,;-.44,-5.12,;-3.93,-3.81,;-3.2,-2.45,;-1.66,-2.4,;-4.02,-1.15,;-3.3,.21,;-4.11,1.52,;-5.65,1.47,;-6.47,2.77,;-5.74,4.13,;-4.2,4.19,;-3.39,2.88,;.89,-8.97,;2.23,-9.74,;3.56,-8.97,;2.23,-11.28,;.89,-12.05,;-.44,-11.28,;-1.91,-11.75,;-2.38,-13.22,;-2.81,-10.51,;-1.91,-9.26,;-.44,-9.74,;3.56,-12.05,;4.89,-11.28,;3.56,-13.59,;4.89,-14.36,)|
Structure:
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