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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 = 'BDBM479440'   
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))		BDBM479440
PNG
(US10894807, ID P249)
Show SMILES OC(=O)CCC(NC(=O)N[C@@H](CCCCNC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)-n1cc(CCCF)nn1)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C29H39FN8O9/c30-12-3-4-20-18-38(35-34-20)21-8-6-19(7-9-21)25(41)36-14-16-37(17-15-36)29(47)31-13-2-1-5-22(26(42)43)32-28(46)33-23(27(44)45)10-11-24(39)40/h6-9,18,22-23H,1-5,10-17H2,(H,31,47)(H,39,40)(H,42,43)(H,44,45)(H2,32,33,46)/t22-,23?/m0/s1
PDB
MMDB

KEGG

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PC cid
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US Patent
 9.40n/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