BDBM86748 CAS_386750-22-7::Desvenlafaxine::NSC_6918664::O-Desmethylvenlafaxine::US9944618, Compound ID No. 181

SMILES: CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1

InChI Key: InChIKey=KYYIDSXMWOZKMP-UHFFFAOYSA-N

Data: 31 KI  10 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 41 hits for monomerid = 86748   

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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.16E+3	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-1A adrenergic receptor (Rat)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.51E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
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Potassium voltage-gated channel subfamily D member 3 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.01E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Sodium channel protein type 5 subunit alpha (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sodium channel protein type 5 subunit alpha (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.16E+5	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	538	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	53	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		4.10	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		7.70	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
Sodium-dependent serotonin transporter (Rat)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		20	n/a	n/a	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		47.3	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		115	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		531	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		558	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		668	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Norepinephrine transporter (Rat)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		938	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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		2.75E+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 noradrenaline transporter (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		3.15E+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 noradrenaline transporter (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		3.39E+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 dopamine transporter (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) Show SMILES Show InChI	GoogleScholar	UniChem		3.73E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Muscarinic acetylcholine receptor M4 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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Adenosine receptor A1 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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Adenosine receptor A2b (Bovine)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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Adenosine 3'-phospho 5'-phosphosulfate transporter 1 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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Cannabinoid receptor 1 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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Cannabinoid receptor 2 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
Muscarinic acetylcholine receptor M1 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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Muscarinic acetylcholine receptor M2 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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Muscarinic acetylcholine receptor M3 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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Muscarinic acetylcholine receptor M5 (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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
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D(1A) dopamine receptor (Human)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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 (Rat)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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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Hrh3 protein (Rat)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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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Histamine H2 receptor (Guinea pig)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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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Histamine H1 receptor (Bovine)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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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Transporter (Guinea pig)	BDBM86748 (CAS_386750-22-7 | NSC_6918664 | O-Desmethylvenlafa...) 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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