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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glutamate carboxypeptidase 2' and Ligand = 'BDBM479441'   
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
Glutamate carboxypeptidase 2


(Homo sapiens (Human))		BDBM479441
PNG
(US10894807, ID P250)
Show SMILES OC(=O)CC[C@H](NC(=O)N[C@@H](CC1CCN(CC1)C(=S)Nc1ccc(cc1)-n1cc(CCCF)nn1)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C26H34FN7O7S/c27-11-1-2-18-15-34(32-31-18)19-5-3-17(4-6-19)28-26(42)33-12-9-16(10-13-33)14-21(24(39)40)30-25(41)29-20(23(37)38)7-8-22(35)36/h3-6,15-16,20-21H,1-2,7-14H2,(H,28,42)(H,35,36)(H,37,38)(H,39,40)(H2,29,30,41)/t20-,21-/m0/s1
PDB
MMDB

KEGG

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PC cid
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UniChem
US Patent
 4.10n/an/an/an/an/an/an/an/a



Siemens Medical Solutions USA, Inc.

US Patent


Assay Description
The inhibitory activity of all compounds was determined using a fluorescent assay of human PSMA activity. The enzyme used in the assay was purchased ...

US Patent US10894807 (2021)


BindingDB Entry DOI: 10.7270/Q2SN0D25
More data for this
Ligand-Target Pair