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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50241215   
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
Protein-glutamine gamma-glutamyltransferase 2


(Homo sapiens (Human))
BDBM50241215
PNG
(CHEMBL4084496)
Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCNC(=O)[C@H](CCCCNC(=O)C=C)NC(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C32H41N5O6S/c1-4-30(38)33-20-9-8-17-27(36-32(40)43-23-24-13-6-5-7-14-24)31(39)34-21-12-22-35-44(41,42)29-19-11-15-25-26(29)16-10-18-28(25)37(2)3/h4-7,10-11,13-16,18-19,27,35H,1,8-9,12,17,20-23H2,2-3H3,(H,33,38)(H,34,39)(H,36,40)/t27-/m0/s1
PDB
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KEGG

UniProtKB/SwissProt

B.MOAD
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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.05E+4n/an/an/an/an/an/an/an/a



University of Ottawa

Curated by ChEMBL


Assay Description
Irreversible inhibition of human TG2 using AL5 as substrate by double reciprocal plot method


J Med Chem 60: 7910-7927 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01070
BindingDB Entry DOI: 10.7270/Q2CN7615
More data for this
Ligand-Target Pair