Reaction Details Report a problem with these data
Target
Histone-lysine N-methyltransferase EZH2 [A687V]
Ligand
BDBM190190
Substrate
n/a
Meas. Tech.
Inhibition Assay
IC50
6.7±n/a nM
Citation
 Kuntz, KW; Knutson, SK; Wigle, TJ Inhibitors of human EZH2, and methods of use thereof US Patent  US9175331 Publication Date 11/3/2015 
Target
Name:
Histone-lysine N-methyltransferase EZH2 [A687V]
Synonyms:
EZH2 | EZH2_HUMAN | Histone-lysine N-methyltransferase EZH2 (A687V) | KMT6
Type:
Protein
Mol. Mass.:
85395.90
Organism:
Homo sapiens (Human)
Description:
Q15910[A687V]
Residue:
746
Sequence:
MGQTGKKSEKGPVCWRKRVKSEYMRLRQLKRFRRADEVKSMFSSNRQKILERTEILNQEWKQRRIQPVHILTSVSSLRGTRECSVTSDLDFPTQVIPLKTLNAVASVPIMYSWSPLQQNFMVEDETVLHNIPYMGDEVLDQDGTFIEELIKNYDGKVHGDRECGFINDEIFVELVNALGQYNDDDDDDDGDDPEEREEKQKDLEDHRDDKESRPPRKFPSDKIFEAISSMFPDKGTAEELKEKYKELTEQQLPGALPPECTPNIDGPNAKSVQREQSLHSFHTLFCRRCFKYDCFLHPFHATPNTYKRKNTETALDNKPCGPQCYQHLEGAKEFAAALTAERIKTPPKRPGGRRRGRLPNNSSRPSTPTINVLESKDTDSDREAGTETGGENNDKEEEEKKDETSSSSEANSRCQTPIKMKPNIEPPENVEWSGAEASMFRVLIGTYYDNFCAIARLIGTKTCRQVYEFRVKESSIIAPAPAEDVDTPPRKKKRKHRLWAAHCRKIQLKKDGSSNHVYNYQPCDHPRQPCDSSCPCVIAQNFCEKFCQCSSECQNRFPGCRCKAQCNTKQCPCYLAVRECDPDLCLTCGAADHWDSKNVSCKNCSIQRGSKKHLLLAPSDVAGWGIFIKDPVQKNEFISEYCGEIISQDEADRRGKVYDKYMCSFLFNLNNDFVVDATRKGNKIRFVNHSVNPNCYAKVMMVNGDHRIGIFAKRAIQTGEELFFDYRYSQADALKYVGIEREMEIP
  
Inhibitor
Name:
BDBM190190
Synonyms:
EPZ007648 | US9175331, 18
Type:
Small organic molecule
Emp. Form.:
C27H37ClN4O2
Mol. Mass.:
485.061
SMILES:
CCN([C@H]1CC[C@@H](CC1)N1CCC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C |r,wU:3.2,wD:6.9,(-5.33,1.47,;-5.33,-.07,;-4,-.84,;-4,-2.38,;-2.67,-3.15,;-2.67,-4.69,;-4,-5.46,;-5.33,-4.69,;-5.33,-3.15,;-4,-7,;-5.09,-8.08,;-4,-9.17,;-2.91,-8.08,;-2.67,-.07,;-1.33,-.84,;,-.07,;1.33,-.84,;,1.47,;-1.33,2.24,;-1.33,3.78,;-2.67,4.55,;,4.55,;,6.09,;1.33,6.86,;1.33,8.4,;,9.17,;2.67,9.17,;4,8.4,;5.33,9.17,;4,6.86,;2.67,6.09,;2.67,4.55,;-2.67,1.47,;-4,2.24,)|
Structure:
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