BDBM194780 7-(4-(4-(1-benzothiophen-4-yl)piperazin-1-yl)butoxy)quinolin-2(1H)-one::OPC 34712::Rexulti::US9206167, 1::USRE48059, Compound of Example 1::brexpiprazole

SMILES: O=c1ccc2ccc(OCCCCN3CCN(CC3)c3cccc4sccc34)cc2[nH]1

InChI Key: InChIKey=ZKIAIYBUSXZPLP-UHFFFAOYSA-N

Data: 16 KI  5 EC50

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 21 hits for monomerid = 194780   

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
D(2) dopamine receptor (Human)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a
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D(2) dopamine receptor (Human)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	16	n/a	n/a	n/a	n/a
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D(2) dopamine receptor (Human)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	16	n/a	n/a	n/a	n/a
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D(2) dopamine receptor (Human)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	6.30	n/a	n/a	n/a	n/a
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D(2) dopamine receptor (Human)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 1A (Rat)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.0900	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)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.120	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)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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D(2) dopamine receptor (Rat)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.200	-13.2	n/a	n/a	n/a	n/a	n/a	7.4	25
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D(2) dopamine receptor (Rat)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.200	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)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.300	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)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 2B (Human)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.398	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)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.470	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)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.470	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
D(2) dopamine receptor (Human)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.510	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
D(2) dopamine receptor (Human)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		0.513	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 2A (Rat)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		2.30	-12.3	n/a	n/a	n/a	n/a	n/a	7.4	37
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					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rat)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		2.30	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)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		3.70	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
D(2) dopamine receptor (Rat)	BDBM194780 (US9206167, 1 | brexpiprazole | 7-(4-(4-(1-benzothi...) Show SMILES Show InChI	GoogleScholar	UniChem		3.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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