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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Isoleucine--tRNA ligase' and Ligand = 'BDBM50227812'   
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
Isoleucine--tRNA ligase


(Escherichia coli)		BDBM50227812
PNG
(CHEMBL288953)
Show SMILES [H][C@]1(O[C@H]1CC1CO[C@@H](C\C(C)=C\C(=O)c2ccccc2)[C@H](O)[C@@H]1O)[C@@H](C)[C@H](C)O
Show InChI InChI=1S/C23H32O6/c1-13(9-18(25)16-7-5-4-6-8-16)10-19-22(27)21(26)17(12-28-19)11-20-23(29-20)14(2)15(3)24/h4-9,14-15,17,19-24,26-27H,10-12H2,1-3H3/b13-9+/t14-,15-,17?,19-,20-,21+,22-,23-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 494n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Isoleucyl-tRNA synthetase

J Med Chem 32: 151-60 (1989)


BindingDB Entry DOI: 10.7270/Q28054TD
More data for this
Ligand-Target Pair