BDBM35226 (S,S)-reboxetine::Reboxetine::Vestra

SMILES: CCOc1ccccc1O[C@@H](c2ccccc2)[C@@H]3CNCCO3

InChI Key: InChIKey=CBQGYUDMJHNJBX-UHFFFAOYSA-N

Data: 26 KI  6 IC50

PDB links: 1 PDB ID matches this monomer.

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 32 hits for monomerid = 35226   

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
Transporter (Rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Sodium-dependent serotonin transporter (Rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2D6 (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent noradrenaline transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent noradrenaline transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		0.300	-13.5	n/a	n/a	n/a	n/a	n/a	7.4	37
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Norepinephrine transporter (Rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		5.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		15.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		107	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		162	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		440	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 2C (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		457	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Nicotinic acetylcholine receptor (Cape York rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 1B (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 1D (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (Mouse)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Alpha-2C adrenergic receptor (Rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Nicotinic acetylcholine receptor (Cape York rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Nicotinic acetylcholine receptor (Cape York rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Alpha-1A adrenergic receptor (Rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Alpha-1A adrenergic receptor (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rat)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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D(3) dopamine receptor (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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D(2) dopamine receptor (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Alpha-2A adrenergic receptor (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Human)	BDBM35226 (Vestra | Reboxetine | (S,S)-reboxetine) Show SMILES Show InChI	GoogleScholar	UniChem		2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair