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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50135750'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Histone deacetylase


(Cryptosporidium parvum)		BDBM50135750
PNG
(6-[(6S,9S,12S,14aR)-6-sec-Butyl-9-(1-methoxy-1H-in...)
Show SMILES CCC(C)[C@@H]1NC(=O)[C@H](Cc2cn(OC)c3ccccc23)NC(=O)[C@H](CCCCCC(O)=O)NC(=O)[C@H]2CCCCN2C1=O
Show InChI InChI=1S/C32H45N5O7/c1-4-20(2)28-32(43)36-17-11-10-15-26(36)31(42)33-23(13-6-5-7-16-27(38)39)29(40)34-24(30(41)35-28)18-21-19-37(44-3)25-14-9-8-12-22(21)25/h8-9,12,14,19-20,23-24,26,28H,4-7,10-11,13,15-18H2,1-3H3,(H,33,42)(H,34,40)(H,35,41)(H,38,39)/t20?,23-,24-,26+,28-/m0/s1
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Aton Pharma, Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration determined against Histone deacetylase from Eimeria tenella

J Med Chem 46: 5097-116 (2003)


Article DOI: 10.1021/jm0303094
BindingDB Entry DOI: 10.7270/Q2MP5413
More data for this
Ligand-Target Pair