BDBM5022 (1R*,3R*,4R*)-3-[(1R*)-1-(Acetylamino)pentyl]-4-{[amino(imino)methyl]amino}cyclopentanecarboxylic Acid::(1R,3R,4R)-3-carbamimidamido-4-[(1R)-1-acetamidopentyl]cyclopentane-1-carboxylic acid::Cyclopentane Derivative 36b
SMILES: [H][C@](CCCC)(NC(C)=O)[C@@H]1C[C@H](C[C@H]1N=C(N)N)C(O)=O
InChI Key: InChIKey=FOEDJODWGAJPQM-WRWGMCAJSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Hemagglutinin (Influenza B virus (B/Victoria/70)) | BDBM5022![]() ((1R*,3R*,4R*)-3-[(1R*)-1-(Acetylamino)pentyl]-4-{[...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet ![]() | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.00E+5 | n/a | n/a | n/a | n/a | 6.5 | 37 |
BioCryst Pharmaceuticals, Inc. | Assay Description A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura... | J Med Chem 44: 4379-92 (2001) Article DOI: 10.1021/jm010277p BindingDB Entry DOI: 10.7270/Q2GX48RZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Neuraminidase (Influenza A virus (A/Singapore/1/57(H2N2))) | BDBM5022![]() ((1R*,3R*,4R*)-3-[(1R*)-1-(Acetylamino)pentyl]-4-{[...) | PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet ![]() | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.46E+4 | n/a | n/a | n/a | n/a | 6.5 | 37 |
BioCryst Pharmaceuticals, Inc. | Assay Description A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura... | J Med Chem 44: 4379-92 (2001) Article DOI: 10.1021/jm010277p BindingDB Entry DOI: 10.7270/Q2GX48RZ | |||||||||||
More data for this Ligand-Target Pair |