BDBM50022508 Boc-Pro-Phe-NMe-His-Leu-OHCH2-Val-Ile-Amp::CHEMBL362209
SMILES: CC[C@H](C)[C@H](NC(=O)C(CC(O)C(CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(C)C)C(=O)NCc1ccccn1
InChI Key: InChIKey=SASWSEQJAITMKS-XSBZJUPLSA-N
Data: 3 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Pepsin A (Porcine) | BDBM50022508 (Boc-Pro-Phe-NMe-His-Leu-OHCH2-Val-Ile-Amp | CHEMBL...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 6.80 | n/a | n/a | n/a | n/a | 2.0 | n/a |
University of Wisconsin Curated by ChEMBL | Assay Description Inhibition of porcine pepsin at pH 2.0 | J Med Chem 31: 625-9 (1988) BindingDB Entry DOI: 10.7270/Q2B85742 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cathepsin D (Bos taurus) | BDBM50022508 (Boc-Pro-Phe-NMe-His-Leu-OHCH2-Val-Ile-Amp | CHEMBL...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 6.30 | n/a | n/a | n/a | n/a | 3.2 | n/a |
University of Wisconsin Curated by ChEMBL | Assay Description Inhibition of bovine cathepsin D at pH 3.2 | J Med Chem 31: 625-9 (1988) BindingDB Entry DOI: 10.7270/Q2B85742 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Renin (Homo sapiens (Human)) | BDBM50022508 (Boc-Pro-Phe-NMe-His-Leu-OHCH2-Val-Ile-Amp | CHEMBL...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 2.60 | n/a | n/a | n/a | n/a | 7.4 | n/a |
University of Wisconsin Curated by ChEMBL | Assay Description Inhibition of human renin at pH 6.0 | J Med Chem 31: 625-9 (1988) BindingDB Entry DOI: 10.7270/Q2B85742 | |||||||||||
More data for this Ligand-Target Pair |