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BDBM50468164 CHEMBL4288368

SMILES: CN(C(=O)CCC[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)c1ccc(F)cc1

InChI Key: InChIKey=XMFXGQVXZVLHGT-KBPBESRZSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50468164   
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
Glutamate carboxypeptidase 2


(Homo sapiens (Human))
BDBM50468164
PNG
(CHEMBL4288368)
Show SMILES CN(C(=O)CCC[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)c1ccc(F)cc1 |r|
Show InChI InChI=1S/C19H24FN3O8/c1-23(12-7-5-11(20)6-8-12)15(24)4-2-3-13(17(27)28)21-19(31)22-14(18(29)30)9-10-16(25)26/h5-8,13-14H,2-4,9-10H2,1H3,(H,25,26)(H,27,28)(H,29,30)(H2,21,22,31)/t13-,14-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.200n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PSMA using [3H]NAAG as substrate preincubated for 15 mins followed by substrate addition measured after 20 mins by li...


ACS Med Chem Lett 9: 1099-1104 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00318
BindingDB Entry DOI: 10.7270/Q2Q81GSC
More data for this
Ligand-Target Pair