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SMILES: S=C(N\N=C\c1ccc2ccccc2c1)Nc1cccc2ccccc12

InChI Key: InChIKey=ZSNFFDIEHGRJBQ-HZHRSRAPSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50466483   
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
Low molecular weight protein-tyrosine phosphatase A


(Mycobacterium tuberculosis)		BDBM50466483
PNG
(CHEMBL4287324)
Show SMILES S=C(N\N=C\c1ccc2ccccc2c1)Nc1cccc2ccccc12
Show InChI InChI=1S/C22H17N3S/c26-22(24-21-11-5-9-18-7-3-4-10-20(18)21)25-23-15-16-12-13-17-6-1-2-8-19(17)14-16/h1-15H,(H2,24,25,26)/b23-15+
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.37E+4n/an/an/an/an/an/a



Universidade Federal de Santa Catarina

Curated by ChEMBL


Assay Description
Inhibition of recombinant Mycobacterium tuberculosis PtpA using p-nitrophenyl phosphate as substrate preincubated for 10 mins followed by substrate a...

Bioorg Med Chem 26: 5742-5750 (2018)


Article DOI: 10.1016/j.bmc.2018.10.030
BindingDB Entry DOI: 10.7270/Q26T0QBX
More data for this
Ligand-Target Pair