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BDBM50104417 (S)-2-Amino-4-((1R,5S)-5,9,9-trimethyl-2,4-dioxa-3-bora-tricyclo[6.1.1.0*1,5*]dec-3-yl)-butyric acid tert-butyl ester::CHEMBL419857

SMILES: CC(C)(C)OC(=O)[C@@H](N)CCB1O[C@@]23CC(CC[C@]2(C)O1)C3(C)C

InChI Key: InChIKey=NFHSRXSGHDFJEV-UYHHSLQTSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50104417   
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
Glutamyl-tRNA(Gln) amidotransferase subunit C


(Streptococcus pyogenes serotype M1)		BDBM50104417
PNG
((S)-2-Amino-4-((1R,5S)-5,9,9-trimethyl-2,4-dioxa-3...)
Show SMILES CC(C)(C)OC(=O)[C@@H](N)CCB1O[C@@]23CC(CC[C@]2(C)O1)C3(C)C
Show InChI InChI=1S/C18H32BNO4/c1-15(2,3)22-14(21)13(20)8-10-19-23-17(6)9-7-12-11-18(17,24-19)16(12,4)5/h12-13H,7-11,20H2,1-6H3/t12?,13-,17-,18+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a>8.00E+4n/an/an/an/an/an/a



DuPont Pharmaceuticals Company

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against Glutaminase activity of bacterial Glu-tRNA-Gln amidotransferase (Glu-AdT)

Bioorg Med Chem Lett 11: 2561-4 (2001)


BindingDB Entry DOI: 10.7270/Q29K49H7
More data for this
Ligand-Target Pair