BDBM50050098 (S)-Phenyl-(S)-piperidin-2-yl-acetic acid methyl ester; hydrochloride::CHEMBL542556::METHYLPHENIDATE

SMILES: COC(=O)[C@H]([C@@H]1CCCCN1)c1ccccc1

InChI Key: InChIKey=DUGOZIWVEXMGBE-UHFFFAOYSA-N

Data: 16 KI  8 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 24 hits for monomerid = 50050098   

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
Sodium-dependent dopamine transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	122	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent noradrenaline transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent noradrenaline transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	788	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent serotonin transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) 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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Sodium-dependent dopamine transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	19.9	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent dopamine transporter (Rat)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	224	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent dopamine transporter (Rat)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	83	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 (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent dopamine transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent dopamine transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent dopamine transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent dopamine transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		50	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 dopamine transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		61	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Norepinephrine transporter (Rat)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		103	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)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		281	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 noradrenaline transporter (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		339	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)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) Show SMILES Show InChI	GoogleScholar	UniChem		1.00E+3	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)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) 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)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) 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(1A) dopamine receptor (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) 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 3A (Mouse)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) 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 2C (Rat)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) 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 (Rat)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) 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 1A (Human)	BDBM50050098 (CHEMBL542556 | METHYLPHENIDATE | (S)-Phenyl-(S)-pi...) 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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