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Target
Histone-lysine N-methyltransferase EZH2
Ligand
BDBM310776
Substrate
n/a
Meas. Tech.
Wild-Type PRC2 Enzyme Assay
IC50
745±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:
BDBM310776
Synonyms:
US10150764, Compound 62
Type:
Small organic molecule
Emp. Form.:
C33H46ClN5O3
Mol. Mass.:
596.203
SMILES:
CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C |r,wU:6.9,wD:3.2,(,.37,;,1.91,;1.33,2.68,;1.33,4.22,;2.67,4.99,;2.67,6.53,;1.33,7.3,;,6.53,;,4.99,;1.33,8.84,;2.67,9.61,;,9.61,;-1.33,8.84,;-1.33,7.3,;-2.67,6.53,;-4,7.3,;-4,8.84,;-5.33,9.61,;-6.67,8.84,;-2.67,9.61,;2.67,1.91,;4,2.68,;5.33,1.91,;6.67,2.68,;5.33,.37,;4,-.4,;4,-1.94,;5.33,-2.71,;2.67,-2.71,;2.67,-4.25,;1.33,-5.02,;1.33,-6.56,;2.67,-7.33,;-.13,-7.03,;-.53,-8.52,;.56,-9.61,;-1.04,-5.79,;-.13,-4.54,;-.53,-3.06,;-2.02,-2.66,;2.67,.37,;1.33,-.4,)|
Structure:
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