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SMILES: COc1ccc2n(CCCCC(=O)NO)cc(C(=O)Nc3ccc(F)cc3)c(=O)c2c1

InChI Key: InChIKey=DYTMIAFYXHIISZ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 65475   
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 1/11/4/6/8


(Homo sapiens (Human))		BDBM65475
PNG
(Quinolone-based HDAC inhibitor 4l)
Show SMILES COc1ccc2n(CCCCC(=O)NO)cc(C(=O)Nc3ccc(F)cc3)c(=O)c2c1
Show InChI InChI=1S/C22H22FN3O5/c1-31-16-9-10-19-17(12-16)21(28)18(13-26(19)11-3-2-4-20(27)25-30)22(29)24-15-7-5-14(23)6-8-15/h5-10,12-13,30H,2-4,11H2,1H3,(H,24,29)(H,25,27)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 32n/an/an/an/an/an/a



Orchid Chemicals & Pharmaceuticals Limited



Assay Description
Histone Deacetylase (HDAC) Inhibition Assay using Boc-Lys(Ac)-AMC Substrate: Inhibition of HDAC has been implicated to modulate transcription and to ...

J Enzyme Inhib Med Chem 29: 555-62 (2014)


Article DOI: 10.3109/14756366.2013.827675
BindingDB Entry DOI: 10.7270/Q22J6916
More data for this
Ligand-Target Pair