BDBM50017934 CHEMBL3289301

SMILES N[C@H]1CC[C@@H](CC1)NC(=O)c1cc(OCc2cccc(c2)C(N)=N)cc(OCc2cccc(c2)C(N)=N)c1

InChI Key InChIKey=UKPKEJBTCDGYRU-RQNOJGIXSA-N

Data  3 KI

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50017934   

TargetSuppressor of tumorigenicity 14 protein(Homo sapiens (Human))
Aurigene Discovery Technologies

Curated by ChEMBL

LigandBDBM50017934(CHEMBL3289301)Copy SMILESCopy InChI

Affinity DataKi:  3nMAssay Description:Inhibition of recombinant matriptase (unknown origin) using Boc-Gln-Ala-Arg-7-amido-4-methyl coumarin hydrobromideMore data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails ArticlePubMedPDB3D Structure (crystal)
Copy BDB DOI

TargetCoagulation factor X(Bos taurus)
Aurigene Discovery Technologies

Curated by ChEMBL

LigandBDBM50017934(CHEMBL3289301)Copy SMILESCopy InChI

Affinity DataKi:  157nMAssay Description:Inhibition of bovine plasma factor 10a using CH3OCO-D-CHA-Gly-Arg-pNA.AcoH substrateMore data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADDrugBankGoogleScholar

Ligand InfoCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails ArticlePubMed
Copy BDB DOI

TargetProthrombin(Homo sapiens (Human))
Aurigene Discovery Technologies

Curated by ChEMBL

LigandBDBM50017934(CHEMBL3289301)Copy SMILESCopy InChI

Affinity DataKi:  1.29E+3nMAssay Description:Inhibition of human thrombin using Boc-Gln-Ala-Arg-7-amido-4-methyl coumarin hydrobromideMore data for this Ligand-Target Pair

Target InfoPDBReactome pathway
UniProtKB/SwissProt
antibodypediaGoogleScholar

Ligand InfoCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails ArticlePubMed
Copy BDB DOI