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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50400633   
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))
BDBM50400633
PNG
(CHEMBL2203473)
Show SMILES Cc1cccc(n1)N1CCN(CC1)C(=O)[C@H](CCCCNC(=O)C=C)NC(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C27H35N5O4/c1-3-25(33)28-15-8-7-13-23(30-27(35)36-20-22-11-5-4-6-12-22)26(34)32-18-16-31(17-19-32)24-14-9-10-21(2)29-24/h3-6,9-12,14,23H,1,7-8,13,15-20H2,2H3,(H,28,33)(H,30,35)/t23-/m0/s1
PDB
MMDB

KEGG

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 55n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Irreversible inhibition of transglutaminase 2


ACS Med Chem Lett 3: 1024-1028 (2012)


Article DOI: 10.1021/ml300241m
BindingDB Entry DOI: 10.7270/Q2TB1823
More data for this
Ligand-Target Pair