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BDBM85126 Thr1 inhibitor, 6

SMILES: CC1NN(c2nc(cc(O)c12)C(F)(F)F)c1ccccc1

InChI Key: InChIKey=BRNIETYMZWARTR-UHFFFAOYSA-N

Data: 1 KI

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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 = 85126   
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
Homoserine kinase


(Escherichia coli)		BDBM85126
PNG
(Thr1 inhibitor, 6)
Show SMILES CC1NN(c2nc(cc(O)c12)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C14H12F3N3O/c1-8-12-10(21)7-11(14(15,16)17)18-13(12)20(19-8)9-5-3-2-4-6-9/h2-8,19H,1H3,(H,18,21)
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
 8.60E+3 -7.18n/an/an/an/an/a7.537



McMaster University



Assay Description
The phosphorylation of L-Hse was monitored by coupling the formation of ADP with pyruvate kinase and lactate dehydrogenase (PK/LDH). The resulting o...

Chembiochem 12: 1179-82 (2011)


Article DOI: 10.1002/cbic.201100121
BindingDB Entry DOI: 10.7270/Q24T6GWV
More data for this
Ligand-Target Pair