BDBM50012620 3-hydroxy-4-(4-hydroxyphenyl)-4-[2-methyl-1-[2-methyl-1-benzyloxycarboxamido-(1S)-propylcarboxamido]-(1S)-propylcarboxamido]butanoic acid::CHEMBL306067
SMILES: CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)NC(C(O)CC(O)=O)c1ccc(O)cc1
InChI Key: InChIKey=COTONBZMPNFRBG-LWXYIGGYSA-N
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) | BDBM50012620 (3-hydroxy-4-(4-hydroxyphenyl)-4-[2-methyl-1-[2-met...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | PubMed | 1.13E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arkansas Curated by ChEMBL | Assay Description Compound was measured for the inhibition of pepsin hydrolysis of hemoglobin. | J Med Chem 34: 2298-300 (1991) BindingDB Entry DOI: 10.7270/Q28G8JPJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Pepsin A (Porcine) | BDBM50012620 (3-hydroxy-4-(4-hydroxyphenyl)-4-[2-methyl-1-[2-met...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.13E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arkansas Curated by ChEMBL | Assay Description Compound was measured for the inhibition of pepsin hydrolysis of hemoglobin. | J Med Chem 34: 2298-300 (1991) BindingDB Entry DOI: 10.7270/Q28G8JPJ | |||||||||||
More data for this Ligand-Target Pair |