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BDBM272133 (R)-5-(3-Fluoro-2-methylphenyl)-N-hydroxy-2-(1- methyl-1H-pyrazol-5-yl)-5,6-dihydro-4H- cyclopenta[d]thiazole-5-carboxamide::US10065948, 69::US10457675, Example 69

SMILES: Cc1c(F)cccc1[C@]1(Cc2nc(sc2C1)-c1ccnn1C)C(=O)NO

InChI Key: InChIKey=NRSVTTYMWNRDOQ-GOSISDBHSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 272133   
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 9


(Homo sapiens (Human))
BDBM272133
PNG
((R)-5-(3-Fluoro-2-methylphenyl)-N-hydroxy-2-(1- me...)
Show SMILES Cc1c(F)cccc1[C@]1(Cc2nc(sc2C1)-c1ccnn1C)C(=O)NO |r|
Show InChI InChI=1S/C18H17FN4O2S/c1-10-11(4-3-5-12(10)19)18(17(24)22-25)8-13-15(9-18)26-16(21-13)14-6-7-20-23(14)2/h3-7,25H,8-9H2,1-2H3,(H,22,24)/t18-/m1/s1
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KEGG

UniProtKB/SwissProt

DrugBank
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PC cid
PC sid
UniChem
US Patent
n/an/a 44n/an/an/an/an/an/a



CHDI Foundation, Inc.

US Patent


Assay Description
The potency of the compounds is quantified by measuring the Histone Deacetylase 9 (HDAC9) enzymatic activity using the fluorogenic substrate, Boc-Lys...


US Patent US10457675 (2019)


BindingDB Entry DOI: 10.7270/Q22J6F7J
More data for this
Ligand-Target Pair
Histone deacetylase 9


(Homo sapiens (Human))
BDBM272133
PNG
((R)-5-(3-Fluoro-2-methylphenyl)-N-hydroxy-2-(1- me...)
Show SMILES Cc1c(F)cccc1[C@]1(Cc2nc(sc2C1)-c1ccnn1C)C(=O)NO |r|
Show InChI InChI=1S/C18H17FN4O2S/c1-10-11(4-3-5-12(10)19)18(17(24)22-25)8-13-15(9-18)26-16(21-13)14-6-7-20-23(14)2/h3-7,25H,8-9H2,1-2H3,(H,22,24)/t18-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 44n/an/an/an/an/an/a



CHDI Foundation, Inc.

US Patent


Assay Description
The potency of the compounds is quantified by measuring the Histone Deacetylase 9 (HDAC9) enzymatic activity using the fluorogenic substrate, Boc-Lys...


US Patent US10065948 (2018)


BindingDB Entry DOI: 10.7270/Q2154K23
More data for this
Ligand-Target Pair