BDBM13808 (2S)-N-[(1S)-1-carbamoyl-2-[4-(1,1,3-trioxo-1,2-thiazolidin-5-yl)phenyl]ethyl]-3-phenyl-2-(phenylformamido)propanamide::IZD 3

SMILES NC(=O)[C@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1

InChI Key InChIKey=ZSFPNCCMRAHJSA-NTZARQNWSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 13808   

TargetTyrosine-protein phosphatase non-receptor type 1(Homo sapiens (Human))TBA

LigandBDBM13808((2S)-N-[(1S)-1-carbamoyl-2-[4-(1,1,3-trioxo-1,2-th...)Copy SMILESCopy InChI

Affinity DataIC50:  1.50E+5nMAssay Description:Inhibition of Homo sapiens (human) PTP1B expressed in Escherichia coli using PNPP as substrateMore data for this Ligand-Target Pair

Target InfoPDBMMDBNCI pathwayReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPC cidPC sidPDBPatentsSimilars

In DepthDetails ArticlePDB3D Structure (crystal)
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TargetTyrosine-protein phosphatase non-receptor type 1 [1-298](Homo sapiens (Human))
Incyte

LigandBDBM13808((2S)-N-[(1S)-1-carbamoyl-2-[4-(1,1,3-trioxo-1,2-th...)Copy SMILESCopy InChI

Affinity DataIC50:  185nMpH: 7.0 T: 2°CAssay Description:The activity of PTP1B enzyme was assayed with 4-nitrophenyl phosphate (pNPP) as substrate. Rate of formation of the phenolate ion was monitored at 41...More data for this Ligand-Target Pair

Target InfoPDBMMDB
UniProtKB/SwissProt
B.MOADDrugBankGoogleScholar

Ligand InfoPC cidPC sidPDBPatentsSimilars

In DepthDetails ArticlePubMedPDB3D Structure (crystal)
Copy BDB DOI