BDBM5025 Oseltamivir::US10919856, POSITIVE CONTROL::ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylate

SMILES: [H][C@@]1(OC(CC)CC)C=C(C[C@H](N)[C@H]1NC(C)=O)C(=O)OCC

InChI Key: InChIKey=VSZGPKBBMSAYNT-UHFFFAOYSA-N

Data: 2 KI  125 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 127 hits for monomerid = 5025   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neuraminidase (Influenza A virus (A/Singapore/1/57(H2N2)))	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	<1	n/a	n/a	n/a	n/a	6.5	37
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Hemagglutinin (Influenza B virus (B/Victoria/70))	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5	n/a	n/a	n/a	n/a	6.5	37
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Neuraminidase (Influenza A virus (A/turkey/Italy/4426/2000(H7N1)))	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	25	n/a	n/a	n/a	n/a	6.5	37
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Non-structural protein 1 (Influenza A virus (A/turkey/Italy/8000/2002(H7N3)))	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.200	n/a	n/a	n/a	n/a	6.5	37
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Neuraminidase (Influenza A virus (A/turkey/Italy/4426/2000(H7N1)))	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	23.7	n/a	n/a	n/a	n/a	6.5	n/a
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Non-structural protein 1 (Influenza A virus (A/turkey/Italy/8000/2002(H7N3)))	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.120	n/a	n/a	n/a	n/a	6.5	n/a
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Neuraminidase (Influenza A virus (A/Tokyo/3/67(H2N2)))	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	<1	n/a	n/a	n/a	n/a	n/a	n/a
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Neuraminidase [H274Y] (Influenza A virus (A/Tokyo/3/67(H2N2)))	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>10	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 2 (Human)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 4 (Human)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 3 (Human)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Sialidase (Clostridium perfringens)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Sialidase-4 (Human)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Sialidase-2 (Human)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Sialidase-3 (Human)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sialidase-1 (Human)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.18	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.15E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	127	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	15.8	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	755	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.658	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.785	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM5025 (ethyl (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair