BindingDB PrimarySearch

BDBM50198573 (S)-1-(6-((diethylamino)methyl)-1,2,3,4-tetrahydronaphthalen-2-yl)-4-(4-fluorophenethyl)piperazin-2-one::(S)-4-(4-fluorophenethyl)-1-(6-((diethylamino)-methyl)-1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-2-one::CHEMBL214629

SMILES: CCN(CC)Cc1ccc2C[C@H](CCc2c1)N1CCN(CCc2ccc(F)cc2)CC1=O

InChI Key: InChIKey=XWZAXTGZXFCRFU-SANMLTNESA-N

Data: 2 KI 3 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50198573
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Melanin-concentrating hormone receptor 1 (Homo sapiens (Human))	BDBM50198573 ((S)-1-(6-((diethylamino)methyl)-1,2,3,4-tetrahydro...) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at MCHR1 by flash plate radioligand binding assay				Bioorg Med Chem 15: 2092-105 (2007) Article DOI: 10.1016/j.bmc.2006.12.028 BindingDB Entry DOI: 10.7270/Q23R0SK8
Procter & Gamble Pharmaceuticals Curated by ChEMBL					More data for this Ligand-Target Pair
Melanin-concentrating hormone receptor 1 (Homo sapiens (Human))	BDBM50198573 ((S)-1-(6-((diethylamino)methyl)-1,2,3,4-tetrahydro...) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of binding to MCH-R1				Bioorg Med Chem Lett 17: 819-22 (2007) Article DOI: 10.1016/j.bmcl.2006.10.052 BindingDB Entry DOI: 10.7270/Q2736QKD
Procter & Gamble Pharmaceuticals Curated by ChEMBL					More data for this Ligand-Target Pair
Melanin-concentrating hormone receptor 1 (Homo sapiens (Human))	BDBM50198573 ((S)-1-(6-((diethylamino)methyl)-1,2,3,4-tetrahydro...) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of MCHR1				Bioorg Med Chem 15: 2092-105 (2007) Article DOI: 10.1016/j.bmc.2006.12.028 BindingDB Entry DOI: 10.7270/Q23R0SK8
Procter & Gamble Pharmaceuticals Curated by ChEMBL					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50198573 ((S)-1-(6-((diethylamino)methyl)-1,2,3,4-tetrahydro...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of binding to hERG				Bioorg Med Chem Lett 17: 819-22 (2007) Article DOI: 10.1016/j.bmcl.2006.10.052 BindingDB Entry DOI: 10.7270/Q2736QKD
Procter & Gamble Pharmaceuticals Curated by ChEMBL					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50198573 ((S)-1-(6-((diethylamino)methyl)-1,2,3,4-tetrahydro...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of human ERG expressed in HEK293 cells by patch-clamp method				Bioorg Med Chem 15: 2092-105 (2007) Article DOI: 10.1016/j.bmc.2006.12.028 BindingDB Entry DOI: 10.7270/Q23R0SK8
Procter & Gamble Pharmaceuticals Curated by ChEMBL					More data for this Ligand-Target Pair