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SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(C)=O)[C@H](C)O)C(=O)N[C@@H]([C@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(C)C)C(O)=O

InChI Key: InChIKey=AGZWJFSEKXMHEY-LLLFOABASA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50366792   
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
Isoform 4 of Membrane-associated guanylate kinase, WW and PDZ domain-containing protein 3 (4)


(Homo sapiens (Human))
BDBM50366792
PNG
(CHEMBL1790641)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@@H](NC(C)=O)[C@H](C)O)C(=O)N[C@@H]([C@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C38H58N8O11/c1-9-19(4)30(44-34(52)27(14-15-28(39)50)46(8)37(55)32(21(6)48)41-22(7)49)35(53)45-31(20(5)47)36(54)42-26(33(51)43-29(18(2)3)38(56)57)16-23-17-40-25-13-11-10-12-24(23)25/h10-13,17-21,26-27,29-32,40,47-48H,9,14-16H2,1-8H3,(H2,39,50)(H,41,49)(H,42,54)(H,43,51)(H,44,52)(H,45,53)(H,56,57)/t19-,20-,21-,26-,27-,29-,30-,31-,32-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 9.80E+3n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory concentration for MAGI-3 PDZ2 domain


Bioorg Med Chem Lett 12: 2471-4 (2002)


BindingDB Entry DOI: 10.7270/Q2HQ40FV
More data for this
Ligand-Target Pair