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Target
Histone-lysine N-methyltransferase EZH2
Ligand
BDBM310772
Substrate
n/a
Meas. Tech.
Wild-Type PRC2 Enzyme Assay
IC50
20.0±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:
BDBM310772
Synonyms:
US10150764, Compound 57
Type:
Small organic molecule
Emp. Form.:
C31H42ClN5O3
Mol. Mass.:
568.15
SMILES:
CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C |r,wU:6.9,wD:3.2,(,-.25,;,1.29,;1.33,2.06,;1.33,3.6,;2.67,4.37,;2.67,5.91,;1.33,6.68,;,5.91,;,4.37,;1.33,8.22,;2.67,8.99,;,8.99,;-1.33,8.22,;-1.33,6.68,;-2.67,5.91,;-4,6.68,;-4,8.22,;-5.33,8.99,;-6.67,8.22,;-2.67,8.99,;2.67,1.29,;4,2.06,;5.33,1.29,;6.67,2.06,;5.33,-.25,;4,-1.02,;4,-2.56,;5.33,-3.33,;2.67,-3.33,;2.67,-4.87,;1.33,-5.64,;1.33,-7.18,;2.67,-7.95,;-.13,-7.66,;-.9,-8.99,;-1.04,-6.41,;-.13,-5.16,;-.9,-3.83,;2.67,-.25,;1.33,-1.02,)|
Structure:
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