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BDBM50235293 CHEMBL4102456

SMILES: CCN(CC)CCNC(=O)c1ccc(cc1)-c1cn(CCCCCCCC(=O)NO)nn1

InChI Key: InChIKey=BTSARICCGQKBIO-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50235293   
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
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50235293
PNG
(CHEMBL4102456)
Show SMILES CCN(CC)CCNC(=O)c1ccc(cc1)-c1cn(CCCCCCCC(=O)NO)nn1
Show InChI InChI=1S/C23H36N6O3/c1-3-28(4-2)17-15-24-23(31)20-13-11-19(12-14-20)21-18-29(27-25-21)16-9-7-5-6-8-10-22(30)26-32/h11-14,18,32H,3-10,15-17H2,1-2H3,(H,24,31)(H,26,30)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 27n/an/an/an/an/an/a



Georgia Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of HDAC6 (unknown origin)


Bioorg Med Chem Lett 27: 744-749 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.044
BindingDB Entry DOI: 10.7270/Q25B04R4
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50235293
PNG
(CHEMBL4102456)
Show SMILES CCN(CC)CCNC(=O)c1ccc(cc1)-c1cn(CCCCCCCC(=O)NO)nn1
Show InChI InChI=1S/C23H36N6O3/c1-3-28(4-2)17-15-24-23(31)20-13-11-19(12-14-20)21-18-29(27-25-21)16-9-7-5-6-8-10-22(30)26-32/h11-14,18,32H,3-10,15-17H2,1-2H3,(H,24,31)(H,26,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 12n/an/an/an/an/an/a



Georgia Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of HDAC1 (unknown origin)


Bioorg Med Chem Lett 27: 744-749 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.044
BindingDB Entry DOI: 10.7270/Q25B04R4
More data for this
Ligand-Target Pair