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BDBM50341600 (S)-2-amino-N-((S)-1-((S)-1-amino-5-guanidino-1-oxopentan-2-ylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl)-5-guanidinopentanamide::2-Amino-5-guanidino-pentanoic acid [1-((S)-(S)-1-carbamoyl-4-guanidino-butylcarbamoyl)-2-(1H-indol-3-yl)-ethyl]-amide::CHEMBL41644

SMILES: N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O

InChI Key: InChIKey=CJPRHIHRLZZAPV-SZMVWBNQSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50341600   
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
Oligopeptide transporter small intestine isoform


(Homo sapiens (Human))
BDBM50341600
PNG
((S)-2-amino-N-((S)-1-((S)-1-amino-5-guanidino-1-ox...)
Show SMILES N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C23H37N11O3/c24-15(6-3-9-30-22(26)27)20(36)34-18(11-13-12-32-16-7-2-1-5-14(13)16)21(37)33-17(19(25)35)8-4-10-31-23(28)29/h1-2,5,7,12,15,17-18,32H,3-4,6,8-11,24H2,(H2,25,35)(H,33,37)(H,34,36)(H4,26,27,30)(H4,28,29,31)/t15-,17-,18-/m0/s1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.70E+6n/an/an/an/an/an/a



University of Troms£

Curated by ChEMBL


Assay Description
Inhibition of human PEPT1 expressed in Xenopus laevis oocytes assessed as inhibition of glycylsarcosine-induced transport-associated current at -60 m...


J Med Chem 54: 2422-32 (2011)


Article DOI: 10.1021/jm1015704
BindingDB Entry DOI: 10.7270/Q2T153Z3
More data for this
Ligand-Target Pair