Reaction Details Report a problem with these data
Target
Histone deacetylase 8
Ligand
BDBM119695
Substrate
n/a
Meas. Tech.
Enzyme Assay
Temperature
303.15±n/a K
IC50
64.1±n/a nM
Comments
extracted
Citation
 Cossío Mora, FP; Zubia Olascoaga, A; Vara Salazar, Y; San Sebastián Larzabal, EI; Otaegui Ansa, D; Masdeu Margalef, M; Aldaba Arévalo, E Histone deacetylase inhibitors based simultaneously on trisubstituted 1H-pyrroles and aromatic and heteroaromatic spacers US Patent  US8685992 Publication Date 4/1/2014 
Target
Name:
Histone deacetylase 8
Synonyms:
HD8 | HDAC8 | HDAC8_HUMAN | HDACL1 | Histone deacetylase 8 (HDAC-8) | Human HDAC8
Type:
Enzyme
Mol. Mass.:
41749.60
Organism:
Homo sapiens (Human)
Description:
Q9BY41
Residue:
377
Sequence:
MEEPEEPADSGQSLVPVYIYSPEYVSMCDSLAKIPKRASMVHSLIEAYALHKQMRIVKPKVASMEEMATFHTDAYLQHLQKVSQEGDDDHPDSIEYGLGYDCPATEGIFDYAAAIGGATITAAQCLIDGMCKVAINWSGGWHHAKKDEASGFCYLNDAVLGILRLRRKFERILYVDLDLHHGDGVEDAFSFTSKVMTVSLHKFSPGFFPGTGDVSDVGLGKGRYYSVNVPIQDGIQDEKYYQICESVLKEVYQAFNPKAVVLQLGADTIAGDPMCSFNMTPVGIGKCLKYILQWQLATLILGGGGYNLANTARCWTYLTGVILGKTLSSEIPDHEFFTAYGPDYVLEITPSCRPDRNEPHRIQQILNYIKGNLKHVV
  
Inhibitor
Name:
BDBM119695
Synonyms:
US8685992, 14
Type:
Small organic molecule
Emp. Form.:
C23H19N3O4S
Mol. Mass.:
433.48
SMILES:
ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Structure:
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