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BDBM50261752 CHEMBL469275::tert-butyl 3-(3-((5-(hydroxyamino)-5-oxopentyl)carbamoyl)isoxazol-5-yl)phenylcarbamate

SMILES: CC(C)(C)OC(=O)Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCC(=O)NO

InChI Key: InChIKey=HPDGNTVEPAKSPV-UHFFFAOYSA-N

Data: 6 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50261752   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50261752
PNG
(CHEMBL469275 | tert-butyl 3-(3-((5-(hydroxyamino)-...)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCC(=O)NO
Show InChI InChI=1S/C20H26N4O6/c1-20(2,3)29-19(27)22-14-8-6-7-13(11-14)16-12-15(24-30-16)18(26)21-10-5-4-9-17(25)23-28/h6-8,11-12,28H,4-5,9-10H2,1-3H3,(H,21,26)(H,22,27)(H,23,25)
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Article
PubMed
n/an/a 826n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of HDAC1 (unknown origin) after 17 hrs


J Med Chem 51: 4370-3 (2008)


Article DOI: 10.1021/jm8002894
BindingDB Entry DOI: 10.7270/Q27W6C11
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50261752
PNG
(CHEMBL469275 | tert-butyl 3-(3-((5-(hydroxyamino)-...)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCC(=O)NO
Show InChI InChI=1S/C20H26N4O6/c1-20(2,3)29-19(27)22-14-8-6-7-13(11-14)16-12-15(24-30-16)18(26)21-10-5-4-9-17(25)23-28/h6-8,11-12,28H,4-5,9-10H2,1-3H3,(H,21,26)(H,22,27)(H,23,25)
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Article
PubMed
n/an/a 2.98E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of HDAC2 (unknown origin) after 17 hrs


J Med Chem 51: 4370-3 (2008)


Article DOI: 10.1021/jm8002894
BindingDB Entry DOI: 10.7270/Q27W6C11
More data for this
Ligand-Target Pair
Histone deacetylase 10


(Homo sapiens (Human))
BDBM50261752
PNG
(CHEMBL469275 | tert-butyl 3-(3-((5-(hydroxyamino)-...)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCC(=O)NO
Show InChI InChI=1S/C20H26N4O6/c1-20(2,3)29-19(27)22-14-8-6-7-13(11-14)16-12-15(24-30-16)18(26)21-10-5-4-9-17(25)23-28/h6-8,11-12,28H,4-5,9-10H2,1-3H3,(H,21,26)(H,22,27)(H,23,25)
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PubMed
n/an/a 891n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of HDAC10 (unknown origin) after 17 hrs


J Med Chem 51: 4370-3 (2008)


Article DOI: 10.1021/jm8002894
BindingDB Entry DOI: 10.7270/Q27W6C11
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50261752
PNG
(CHEMBL469275 | tert-butyl 3-(3-((5-(hydroxyamino)-...)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCC(=O)NO
Show InChI InChI=1S/C20H26N4O6/c1-20(2,3)29-19(27)22-14-8-6-7-13(11-14)16-12-15(24-30-16)18(26)21-10-5-4-9-17(25)23-28/h6-8,11-12,28H,4-5,9-10H2,1-3H3,(H,21,26)(H,22,27)(H,23,25)
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PubMed
n/an/a 5.81E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of HDAC8 (unknown origin) after 17 hrs


J Med Chem 51: 4370-3 (2008)


Article DOI: 10.1021/jm8002894
BindingDB Entry DOI: 10.7270/Q27W6C11
More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50261752
PNG
(CHEMBL469275 | tert-butyl 3-(3-((5-(hydroxyamino)-...)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCC(=O)NO
Show InChI InChI=1S/C20H26N4O6/c1-20(2,3)29-19(27)22-14-8-6-7-13(11-14)16-12-15(24-30-16)18(26)21-10-5-4-9-17(25)23-28/h6-8,11-12,28H,4-5,9-10H2,1-3H3,(H,21,26)(H,22,27)(H,23,25)
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Article
PubMed
n/an/a 3.98n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of HDAC6 (unknown origin) after 17 hrs


J Med Chem 51: 4370-3 (2008)


Article DOI: 10.1021/jm8002894
BindingDB Entry DOI: 10.7270/Q27W6C11
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50261752
PNG
(CHEMBL469275 | tert-butyl 3-(3-((5-(hydroxyamino)-...)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(c1)-c1cc(no1)C(=O)NCCCCC(=O)NO
Show InChI InChI=1S/C20H26N4O6/c1-20(2,3)29-19(27)22-14-8-6-7-13(11-14)16-12-15(24-30-16)18(26)21-10-5-4-9-17(25)23-28/h6-8,11-12,28H,4-5,9-10H2,1-3H3,(H,21,26)(H,22,27)(H,23,25)
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Article
PubMed
n/an/a 83.6n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of HDAC3 (unknown origin) after 17 hrs


J Med Chem 51: 4370-3 (2008)


Article DOI: 10.1021/jm8002894
BindingDB Entry DOI: 10.7270/Q27W6C11
More data for this
Ligand-Target Pair