BDBM50183057 CHEMBL3818765

SMILES CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(CCSC)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O

InChI Key InChIKey=JYWLVKREVMTEJA-UHFFFAOYSA-N

Data  2 KI

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50183057   

TargetTyrosine-protein phosphatase non-receptor type 1(Homo sapiens (Human))
Chinese Academy Of Sciences

Curated by ChEMBL

LigandBDBM50183057(CHEMBL3818765)Copy SMILESCopy InChI

Affinity DataKi:  76nMAssay Description:Inhibition of PTP1B (unknown origin) using p-nitrophenyl phosphate as substrate by colorimetric methodMore data for this Ligand-Target Pair

Target InfoPDBMMDBNCI pathwayReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoCHEMBLPC cidPC sidPDBSimilars

In DepthDetails ArticlePubMedPDB3D Structure (crystal)
Copy BDB DOI

TargetTyrosine-protein phosphatase non-receptor type 2(Homo sapiens (Human))
Chinese Academy Of Sciences

Curated by ChEMBL

LigandBDBM50183057(CHEMBL3818765)Copy SMILESCopy InChI

Affinity DataKi:  380nMAssay Description:Inhibition of TCPTP (unknown origin) using p-nitrophenyl phosphate as substrate by colorimetric methodMore data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADantibodypediaGoogleScholar

Ligand InfoCHEMBLPC cidPC sidPDBSimilars

In DepthDetails ArticlePubMed
Copy BDB DOI