Reaction Details |
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Target | Histone deacetylase 8 |
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Ligand | BDBM50164514 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1664931 (CHEMBL4014727) |
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IC50 | 138±n/a nM |
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Citation | Ballante, F; Reddy, DR; Zhou, NJ; Marshall, GR Structural insights of SmKDAC8 inhibitors: Targeting Schistosoma epigenetics through a combined structure-based 3D QSAR, in vitro and synthesis strategy. Bioorg Med Chem25:2105-2132 (2017) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Histone deacetylase 8 |
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Name: | Histone deacetylase 8 |
Synonyms: | HDAC8 | Histone deacetylase 8 |
Type: | PROTEIN |
Mol. Mass.: | 49771.73 |
Organism: | Schistosoma mansoni |
Description: | ChEMBL_116785 |
Residue: | 440 |
Sequence: | MSVGIVYGDQYRQLCCSSPKFGDRYALVMDLINAYKLIPELSRVPPLQWDSPSRMYEAVT
AFHSTEYVDALKKLQMLHCEEKELTADDELLMDSFSLNYDCPGFPSVFDYSLAAVQGSLA
AASALICRHCEVVINWGGGWHHAKRSEASGFCYLNDIVLAIHRLVSSTPPETSPNRQTRV
LYVDLDLHHGDGVEEAFWYSPRVVTFSVHHASPGFFPGTGTWNMVDNDKLPIFLNGAGRG
RFSAFNLPLEEGINDLDWSNAIGPILDSLNIVIQPSYVVVQCGADCLATDPHRIFRLTNF
YPNLNLDSDCDSECSLSGYLYAIKKILSWKVPTLILGGGGYNFPDTARLWTRVTALTIEE
VKGKKMTISPEIPEHSYFSRYGPDFELDIDYFPHESHNKTLDSIQKHHRRILEQLRNYAD
LNKLIYDYDQVYQLYNLTGM
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BDBM50164514 |
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n/a |
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Name | BDBM50164514 |
Synonyms: | CHEMBL3799728 |
Type | Small organic molecule |
Emp. Form. | C15H11F3N2O3 |
Mol. Mass. | 324.2546 |
SMILES | ONC(=O)c1ccc(c(NC(=O)c2ccccc2)c1)C(F)(F)F |
Structure |
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