BDBM50103595 Brumetadina::CHEBI:3699::Cimetidine::Tagamet::Tagamet HB::Tagamet HB 200::Valmagen

SMILES: CN\C(NC#N)=N/CCSCc1nc[nH]c1C

InChI Key: InChIKey=AQIXAKUUQRKLND-UHFFFAOYSA-N

Data: 4 KI  11 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 15 hits for monomerid = 50103595   

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
Bile salt export pump (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) 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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Bile salt export pump (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 4 (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 2 (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 3 (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 22 member 4 (Rat)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+6	n/a	n/a	n/a	n/a	n/a	n/a
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Multidrug and toxin extrusion protein 1 (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2J2 (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Histamine H2 receptor (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Histamine H2 receptor (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Histamine H2 receptor (Guinea pig)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Histamine H2 receptor (Guinea pig)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		302	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 22 member 8 (Rat)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		4.68E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 22 member 1 (Human)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		1.66E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 22 member 6 (Rat)	BDBM50103595 (CHEBI:3699 | Brumetadina | Cimetidine | Tagamet | ...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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