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Target
Toxopain-2
Ligand
BDBM50271690
Substrate
n/a
Meas. Tech.
ChEMBL_1711555 (CHEMBL4121604)
IC50
2.0±n/a nM
Citation
 Zwicker, JD; Diaz, NA; Guerra, AJ; Kirchhoff, PD; Wen, B; Sun, D; Carruthers, VB; Larsen, SD Optimization of dipeptidic inhibitors of cathepsin L for improved Toxoplasma gondii selectivity and CNS permeability. Bioorg Med Chem Lett 28:1972-1980 (2018) [PubMed]  Article 
Target
Name:
Toxopain-2
Synonyms:
CPL | Cathepsin L | Toxopain-2
Type:
PROTEIN
Mol. Mass.:
47549.50
Organism:
Toxoplasma gondii
Description:
ChEMBL_118107
Residue:
422
Sequence:
MDSSETHYVSFLNGEDDGLENGELHQRRGVRAGRPSPPFVVTTRTYFWKKFLRQRNFTARAWIALVAAAVSLLVFASFLIQWQGEDDRAVFPPSPVEDHQPPANIWEWKEAHFQDAFSSFQAMYAKSYATEEEKQRRYAIFKNNLVYIHTHNQQGYSYSLKMNHFGDLSRDEFRRKYLGFKKSRNLKSHHLGVATELLNVLPSELPAGVDWRSRGCVTPVKDQRDCGSCWAFSTTGALEGAHCAKTGKLVSLSEQELMDCSRAEGNQSCSGGEMNDAFQYVLDSGGICSEDAYPYLARDEECRAQSCEKVVKILGFKDVPRRSEAAMKAALAKSPVSIAIEADQMPFQFYHEGVFDASCGTDLDHGVLLVGYGTDKESKKDFWIMKNSWGTGWGRDGYMYMAMHKGEEGQCGLLLDASFPVM
  
Inhibitor
Name:
BDBM50271690
Synonyms:
CHEMBL222649
Type:
Small organic molecule
Emp. Form.:
C28H37N3O5S
Mol. Mass.:
527.675
SMILES:
CC(C)C[C@@H](NC(=O)N1CCOCC1)C(=O)N[C@H](CCc1ccccc1)\C=C\S(=O)(=O)c1ccccc1 |r|
Structure:
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