BDBM50400902 1-(2-(2,4-dimethylphenylsulfanyl)phenyl)piperazine::CHEMBL2204360::Lu-AA21004::Trintellix::brintellix::vortioxetine hydrobromide

SMILES: Cc1ccc(c(c1)C)Sc2ccccc2N3CCNCC3

InChI Key: InChIKey=YQNWZWMKLDQSAC-UHFFFAOYSA-N

Data: 29 KI  16 IC50  3 EC50

PDB links: 3 PDB IDs match 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 48 hits for monomerid = 50400902   

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
5-hydroxytryptamine receptor 3A (Rat)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.180	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 3A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 3A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a
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Sodium-dependent dopamine transporter (Rat)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent serotonin transporter (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 1A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Sodium-dependent serotonin transporter (Rat)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Sodium-dependent serotonin transporter (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 1B (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	120	n/a	n/a	n/a	n/a
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Sodium-dependent serotonin transporter (Rat)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 3A4 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) 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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Cytochrome P450 1A2 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2D6 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.80E+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 serotonin transporter (Rat)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) 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
Sodium-dependent serotonin transporter (Rat)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2C9 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.90E+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 (Rat)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
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Prostaglandin G/H synthase 2 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
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Prostaglandin G/H synthase 1 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.20	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)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		1.60	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)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		1.60	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 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		3.70	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
5-hydroxytryptamine receptor 3A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		3.70	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		9.5	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		9.5	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		9.5	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		9.5	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)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		15	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		15	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 7 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		19	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 7 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 3A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 7 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		26	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 7 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		26	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
5-hydroxytryptamine receptor 7 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		26	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
5-hydroxytryptamine receptor 7 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		26	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)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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5-hydroxytryptamine receptor 1A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		39	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-1 adrenergic receptor (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Histamine H1 receptor (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Histamine H2 receptor (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 2A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		180	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)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 5A (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 3A (Rat)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 6 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		330	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 7 (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-2 adrenergic receptor (Human)	BDBM50400902 (CHEMBL2204360 | vortioxetine hydrobromide | 1-(2-(...) Show SMILES Show InChI	GoogleScholar	UniChem		560	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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