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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 22' and Ligand = 'BDBM50132462'   
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
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))		BDBM50132462
PNG
(5-{(S)-2-tert-Butoxycarbonylamino-2-[4-(2-methoxyc...)
Show SMILES COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)OC(C)(C)C
Show InChI InChI=1S/C29H36N2O12/c1-29(2,3)43-28(39)31-19(15-17-10-11-21(42-16-23(33)34)18(14-17)26(36)37)25(35)30-12-5-6-13-41-22-9-7-8-20(32)24(22)27(38)40-4/h7-11,14,19,32H,5-6,12-13,15-16H2,1-4H3,(H,30,35)(H,31,39)(H,33,34)(H,36,37)/t19-/m0/s1
PDB

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Similars
PubMed
>3.00E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of T-cell Protein Tyrosine Phosphatase (TCPTP)

Bioorg Med Chem Lett 13: 3129-32 (2003)


BindingDB Entry DOI: 10.7270/Q24B30QV
More data for this
Ligand-Target Pair