BDBM50111464 (1S,5S)-4-((S)-3-(3,4-Difluoro-phenyl)-2-{3-[(5-methyl-isoxazole-3-carbonyl)-amino]-2-oxo-2H-pyridin-1-yl}-propionylamino)-5-(2-oxo-pyrrolidin-3-yl)-pent-2-enoic acid ethyl ester::4-(3-(3,4-Difluoro-phenyl)-2-{3-[(5-methyl-isoxazole-3-carbonyl)-amino]-2-oxo-2H-pyridin-1-yl}-propionylamino)-5-(2-oxo-pyrrolidin-3-yl)-pent-2-enoic acid ethyl ester::CHEMBL291277
SMILES: CCOC(=O)\C=C\[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](Cc1ccc(F)c(F)c1)n1cccc(NC(=O)c2cc(C)on2)c1=O
InChI Key: InChIKey=DMEUCWDOSVXQPQ-VVVXHSQNSA-N
Data: 3 EC50
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) | BDBM50111464![]() ((1S,5S)-4-((S)-3-(3,4-Difluoro-phenyl)-2-{3-[(5-me...) | MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | n/a | n/a | 6 | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development-La Jolla/Agouron Pharmaceuticals Curated by ChEMBL | Assay Description antirhinoviral activity against HRV Protease 3CP (serotype 1A) | J Med Chem 45: 1607-23 (2002) BindingDB Entry DOI: 10.7270/Q27M078G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Human rhinovirus A protease (Human rhinovirus B) | BDBM50111464![]() ((1S,5S)-4-((S)-3-(3,4-Difluoro-phenyl)-2-{3-[(5-me...) | MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | n/a | n/a | 1 | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development-La Jolla/Agouron Pharmaceuticals Curated by ChEMBL | Assay Description Inhibition of HRV Protease 3CP (serotype 14). | J Med Chem 45: 1607-23 (2002) BindingDB Entry DOI: 10.7270/Q27M078G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Human rhinovirus A protease (Human rhinovirus B) | BDBM50111464![]() ((1S,5S)-4-((S)-3-(3,4-Difluoro-phenyl)-2-{3-[(5-me...) | MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | n/a | n/a | 5 | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development-La Jolla/Agouron Pharmaceuticals Curated by ChEMBL | Assay Description antirhinoviral activity against HRV Protease 3CP (serotype 10) | J Med Chem 45: 1607-23 (2002) BindingDB Entry DOI: 10.7270/Q27M078G | |||||||||||
More data for this Ligand-Target Pair |