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BDBM95810 MLS000999870::N-(4-Methoxy-benzyl)-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)-acetamide::N-[(4-methoxyphenyl)methyl]-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetamide::N-[(4-methoxyphenyl)methyl]-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)ethanamide::N-[(4-methoxyphenyl)methyl]-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylthio)acetamide::N-p-anisyl-2-(5H-[1,2,4]triazin[5,6-b]indol-3-ylthio)acetamide::SMR000607014::cid_8917283

SMILES: COc1ccc(CNC(=O)CSc2nnc3c(n2)[nH]c2ccccc32)cc1

InChI Key: InChIKey=GQALJGQWKDPECB-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 95810   
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
methionyl-tRNA synthetase


(Trypanosoma brucei brucei strain 927/4 GUTat10.1)
BDBM95810
PNG
(MLS000999870 | N-(4-Methoxy-benzyl)-2-(5H-[1,2,4]t...)
Show SMILES COc1ccc(CNC(=O)CSc2nnc3c(n2)[nH]c2ccccc32)cc1
Show InChI InChI=1S/C19H17N5O2S/c1-26-13-8-6-12(7-9-13)10-20-16(25)11-27-19-22-18-17(23-24-19)14-4-2-3-5-15(14)21-18/h2-9H,10-11H2,1H3,(H,20,25)(H,21,22,24)
PDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.54E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2XP73JZ
More data for this
Ligand-Target Pair