BDBM50120045 2-{[2-(1H-Benzoimidazol-2-ylmethyl)-3-(2,2-dimethyl-propyl)-3H-benzoimidazole-5-carbonyl]-amino}-3-phosphono-propionic acid::CHEMBL104015
SMILES: CC(C)(C)Cn1c(Cc2nc3ccccc3[nH]2)nc2ccc(cc12)C(=O)NC(CP(O)(O)=O)C(O)=O
InChI Key: InChIKey=NTTQHPYEMYJKMD-UHFFFAOYSA-N
Data: 2 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Hepatitis C virus serine protease, NS3/NS4A (Hepatitis C virus) | BDBM50120045 (2-{[2-(1H-Benzoimidazol-2-ylmethyl)-3-(2,2-dimethy...) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 610 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Celera Curated by ChEMBL | Assay Description Inhibition of HCV serine protease NS3/NS4A in the presence of Zn | Bioorg Med Chem Lett 12: 3129-33 (2002) BindingDB Entry DOI: 10.7270/Q25D8R64 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Hepatitis C virus serine protease, NS3/NS4A (Hepatitis C virus) | BDBM50120045 (2-{[2-(1H-Benzoimidazol-2-ylmethyl)-3-(2,2-dimethy...) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Celera Curated by ChEMBL | Assay Description Inhibition of HCV serine protease NS3/NS4A in the presence of EDTA. | Bioorg Med Chem Lett 12: 3129-33 (2002) BindingDB Entry DOI: 10.7270/Q25D8R64 | |||||||||||
More data for this Ligand-Target Pair |