BDBM50136003 (S)-4-((S)-2-Acetylamino-3-carboxy-propionylamino)-4-((R)-(S)-1-{1-[(R)-(R)-1-((S)-1-carboxy-2-mercapto-ethylcarbamoyl)-2-cyclohexyl-ethylcarbamoyl]-2-methyl-butylcarbamoyl}-3-methyl-butylcarbamoyl)-butyric acid::CHEMBL150021
SMILES: CC[C@@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CS)C(O)=O
InChI Key: InChIKey=CSWPZICAVWHBCE-CYVYJVGMSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Human rhinovirus A protease (Human rhinovirus B) | BDBM50136003 ((S)-4-((S)-2-Acetylamino-3-carboxy-propionylamino)...) | MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Schering-Plough Research Institute Curated by ChEMBL | Assay Description Binding constant against hepatitis C virus (HCV) protease | J Med Chem 46: 5360-4 (2003) Article DOI: 10.1021/jm030040o BindingDB Entry DOI: 10.7270/Q20001J6 | |||||||||||
More data for this Ligand-Target Pair |