BDBM44205 1-(3,4-Dihydro-1H-isoquinolin-2-yl)-2-(4-hydroxy-pyrimidin-2-ylsulfanyl)-ethanone::2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-6-one::2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-1H-pyrimidin-6-one::2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-1H-pyrimidin-6-one::2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-1H-pyrimidin-6-one::MLS000123496::SMR000124078::cid_1166770

SMILES: O=C(CSc1nccc(=O)[nH]1)N1CCc2ccccc2C1

InChI Key: InChIKey=SMXUDIJMNQCSNF-UHFFFAOYSA-N

Data: 2 IC50  4 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 6 hits for monomerid = 44205   

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
Solute carrier family 12 member 5 (Human)	BDBM44205 (SMR000124078 | 2-[[2-(3,4-dihydro-1H-isoquinolin-2...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	9.12E+3	n/a	n/a	n/a	n/a
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Solute carrier family 12 member 5 (Human)	BDBM44205 (SMR000124078 | 2-[[2-(3,4-dihydro-1H-isoquinolin-2...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.71E+4	n/a	n/a	n/a	n/a
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Guanine nucleotide-binding protein subunit alpha-15 (Human)	BDBM44205 (SMR000124078 | 2-[[2-(3,4-dihydro-1H-isoquinolin-2...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>2.99E+4	n/a	n/a	n/a	n/a
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Trace amine-associated receptor 1 (Human)	BDBM44205 (SMR000124078 | 2-[[2-(3,4-dihydro-1H-isoquinolin-2...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Human)	BDBM44205 (SMR000124078 | 2-[[2-(3,4-dihydro-1H-isoquinolin-2...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.97E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Guanine nucleotide-binding protein subunit alpha-15 (Human)	BDBM44205 (SMR000124078 | 2-[[2-(3,4-dihydro-1H-isoquinolin-2...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.99E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair