BDBM50325274 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-propylamino]-ethyl}-benzene-1,2-diol::4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-propylamino]-ethyl}-benzene-1,2-diol(Dobutamine)::CHEMBL926::DOBUTAMINE::Dobutrex::cid_36811

SMILES: C[C@H](CCc1ccc(cc1)O)NCCc2ccc(c(c2)O)O

InChI Key: InChIKey=JRWZLRBJNMZMFE-UHFFFAOYSA-N

Data: 13 KI  3 IC50  2 EC50

PDB links: 4 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 18 hits for monomerid = 50325274   

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 2A (Mouse)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	7.61E+4	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 22 member 1 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
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Mu-type opioid receptor (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	9.25E+4	n/a	n/a	n/a	n/a
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Carbonic anhydrase 15 (Mouse)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		390	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 2 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		480	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 5A, mitochondrial (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		730	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 5B, mitochondrial (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 1 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		1.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 7 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 12 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		4.35E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 3 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 4 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		8.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 6 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		9.47E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 13 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		9.53E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 9 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		9.82E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 14 (Human)	BDBM50325274 (Dobutrex | 4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-pro...) Show SMILES Show InChI	GoogleScholar	UniChem		1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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