Reaction Details Report a problem with these data
Target
Histone H3.1 [22-45]
Ligand
BDBM155255
Substrate
n/a
Meas. Tech.
Wild-Type and Mutant PRC2 Enzyme Assays
IC50
104±0 nM
Citation
 Kuntz, KW; Campbell, JE; Seki, M Substituted benzene compounds US Patent  US10098888 Publication Date 10/16/2018 
Target
Name:
Histone H3.1 [22-45]
Synonyms:
H31_HUMAN | H3C1 | H3FA | H3FB | H3FC HIST1H3C | H3FD | H3FF | H3FH | H3FI | H3FJ | H3FK | H3FL | H3K27me3 | HIST1H3A | HIST1H3B | HIST1H3D | HIST1H3E | HIST1H3F | HIST1H3G | HIST1H3H | HIST1H3I | HIST1H3J
Type:
Enzyme Catalytic Domain
Mol. Mass.:
2513.44
Organism:
Homo sapiens (Human)
Description:
P68431[22-45]
Residue:
24
Sequence:
ATKAARKSAPATGGVKKPHRYRPG
  
Inhibitor
Name:
BDBM155255
Synonyms:
US10098888, Compound 105 | US11642348, Compound 105 | US9006242, 105
Type:
Small organic molecule
Emp. Form.:
C31H42N4O3
Mol. Mass.:
518.6902
SMILES:
CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CC1CCN(C)CC1
Structure:
Search PDB for entries with ligand similarity: