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Target
Gastricsin
Ligand
BDBM50427040
Substrate
n/a
Meas. Tech.
ChEMBL_939875 (CHEMBL2329600)
IC50
>30000±n/a nM
Citation
 Ostermann, N; Ruedisser, S; Ehrhardt, C; Breitenstein, W; Marzinzik, A; Jacoby, E; Vangrevelinghe, E; Ottl, J; Klumpp, M; Hartwieg, JC; Cumin, F; Hassiepen, U; Trappe, J; Sedrani, R; Geisse, S; Gerhartz, B; Richert, P; Francotte, E; Wagner, T; Krömer, M; Kosaka, T; Webb, RL; Rigel, DF; Maibaum, J; Baeschlin, DK A novel class of oral direct renin inhibitors: highly potent 3,5-disubstituted piperidines bearing a tricyclic p3-p1 pharmacophore. J Med Chem 56:2196-206 (2013) [PubMed]  Article 
Target
Name:
Gastricsin
Synonyms:
Gastricsin | PEPC_HUMAN | PGC | Pepsinogen C
Type:
PROTEIN
Mol. Mass.:
42409.17
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1452207
Residue:
388
Sequence:
MKWMVVVLVCLQLLEAAVVKVPLKKFKSIRETMKEKGLLGEFLRTHKYDPAWKYRFGDLSVTYEPMAYMDAAYFGEISIGTPPQNFLVLFDTGSSNLWVPSVYCQSQACTSHSRFNPSESSTYSTNGQTFSLQYGSGSLTGFFGYDTLTVQSIQVPNQEFGLSENEPGTNFVYAQFDGIMGLAYPALSVDEATTAMQGMVQEGALTSPVFSVYLSNQQGSSGGAVVFGGVDSSLYTGQIYWAPVTQELYWQIGIEEFLIGGQASGWCSEGCQAIVDTGTSLLTVPQQYMSALLQATGAQEDEYGQFLVNCNSIQNLPSLTFIINGVEFPLPPSSYILSNNGYCTVGVEPTYLSSQNGQPLWILGDVFLRSYYSVYDLGNNRVGFATAA
  
Inhibitor
Name:
BDBM50427040
Synonyms:
CHEMBL2322207
Type:
Small organic molecule
Emp. Form.:
C32H39N3O5S
Mol. Mass.:
577.734
SMILES:
COCCCCC1(CNC(=O)[C@@H]2CNC[C@@H](C2)NS(=O)(=O)c2ccc(C)cc2)c2ccccc2Oc2ccccc12 |r|
Structure:
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