Bromodomain-containing proteins

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  1. Plumbagin, Inhibitor of E1A binding protein p300;Inhibitor of lysine acetyltransferase 2B
    Cas#: 481-42-5        Compound CID:  10205
    Formula:  C11H8O3        Molecular Weight: 188.18
    IUPAC Name: 5-hydroxy-2-methylnaphthalene-1,4-dione
    SMILES: CC1=CC(=O)C2=C(C1=O)C=CC=C2O
    InChIKey: VCMMXZQDRFWYSE-UHFFFAOYSA-N
    InChI: InChI=1S/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H3
    Synonyms: 5-Hydroxy-2-methyl-1,4-naphthalenedione | 5-Hydroxy-2-methyl-1,4-naphthoquinone | BRD-K36137799-001-02-4 | CCG-208410...
  2. BAZ2-ICR, Inhibitor of bromodomain adjacent to zinc finger domain 2A;Inhibitor of bromodomain adjacent to zinc finger domain 2B
    Cas#: 1665195-94-7        Compound CID:  91654625
    Formula:  C20H19N7        Molecular Weight: 357.41
    IUPAC Name: 4-[5-(1-methylpyrazol-4-yl)-3-[2-(1-methylpyrazol-4-yl)ethyl]imidazol-4-yl]benzonitrile
    SMILES: CN1C=C(C=N1)CCN2C=NC(=C2C3=CC=C(C=C3)C#N)C4=CN(N=C4)C
    InChIKey: RRZVGDGTWNQAPW-UHFFFAOYSA-N
    InChI: InChI=1S/C20H19N7/c1-25-12-16(10-23-25)7-8-27-14-22-19(18-11-24-26(2)13-18)20(27)17-5-3-15(9-21)4-6-17/h3-6,10-14H,7-8H2,1-2H3
  3. GSK 2801, Inhibitor of bromodomain adjacent to zinc finger domain 2A;Inhibitor of bromodomain adjacent to zinc finger domain 2B
    Cas#: 1619994-68-1        Compound CID:  73010930
    Formula:  C20H21NO4S        Molecular Weight: 371.45
    IUPAC Name: 1-[1-(2-methylsulfonylphenyl)-7-propoxyindolizin-3-yl]ethanone
    SMILES: CCCOC1=CC2=C(C=C(N2C=C1)C(=O)C)C3=CC=CC=C3S(=O)(=O)C
    InChIKey: KHWCPNJRJCNVRI-UHFFFAOYSA-N
    InChI: InChI=1S/C20H21NO4S/c1-4-11-25-15-9-10-21-18(14(2)22)13-17(19(21)12-15)16-7-5-6-8-20(16)26(3,23)24/h5-10,12-13H,4,11H2,1-3H3
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