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SMILES: OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)c1ccc(I)cc1)C(O)=O)C(O)=O

InChI Key: InChIKey=PGKJMHBBGIMTIG-QORCZRPOSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50544835   
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))		BDBM50544835
PNG
(CHEMBL4649277)
Show SMILES OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)c1ccc(I)cc1)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C33H40IN5O12/c34-21-11-9-20(10-12-21)28(44)36-22(13-15-26(40)41)30(46)37-25(18-19-6-2-1-3-7-19)29(45)35-17-5-4-8-23(31(47)48)38-33(51)39-24(32(49)50)14-16-27(42)43/h1-3,6-7,9-12,22-25H,4-5,8,13-18H2,(H,35,45)(H,36,44)(H,37,46)(H,40,41)(H,42,43)(H,47,48)(H,49,50)(H2,38,39,51)/t22-,23-,24-,25-/m0/s1
PDB
MMDB

KEGG

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DrugBank
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.60n/an/an/an/an/an/a



Beijing Normal University

Curated by ChEMBL


Assay Description
Displacement of [125I]MIP-1095 from PSMA in human PC3-PIP cells after 1 hr by gamma counter analysis

Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115319
BindingDB Entry DOI: 10.7270/Q2CF9TPT
More data for this
Ligand-Target Pair