Reaction Details Report a problem with these data
Target
Gastricsin
Ligand
BDBM50045683
Substrate
n/a
Meas. Tech.
ChEBML_71511
IC50
>100000±n/a nM
Citation
Heitsch, H; Henning, R; Kleemann, HW; Linz, W; Nickel, WU; Ruppert, D; Urbach, H; Wagner, A Renin inhibitors containing a pyridyl amino diol derived C-terminus. J Med Chem 36:2788-800 (1993) [PubMed] Article
More Info.:
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:
BDBM50045683
Synonyms:
4-(4-Amino-piperidin-1-yl)-2-benzyl-N-[1-(1-cyclohexylmethyl-2,3-dihydroxy-5-pyridin-2-yl-pentylcarbamoyl)-2-(1H-imidazol-4-yl)-ethyl]-4-oxo-butyramide | CHEMBL94762
Type:
Small organic molecule
Emp. Form.:
C39H55N7O5
Mol. Mass.:
701.8979
SMILES:
NC1CCN(CC1)C(=O)C[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CCc1ccccn1