SMILES String Search

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 581.7
BDBM50296881

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 7 hits in this display
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Neuropeptide Y receptor type 1 (Homo sapiens (Human))	BDBM50296881 ((1-((1R,4R)-4-((S)-2,2-difluoro-1-(4-methoxyphenyl...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [125I]PYY from human recombinant neuropeptide Y1 receptor expressed in CHO (NFAT-bla) cells by scintillation counting				Bioorg Med Chem Lett 19: 4781-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.050 BindingDB Entry DOI: 10.7270/Q2319VXR
Tsukuba Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 1 (Homo sapiens (Human))	BDBM50296881 ((1-((1R,4R)-4-((S)-2,2-difluoro-1-(4-methoxyphenyl...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human neuropeptide Y1 receptor expressed in HEK293 cells by [35S]GTPgammaS binding assay				Bioorg Med Chem Lett 19: 4781-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.050 BindingDB Entry DOI: 10.7270/Q2319VXR
Tsukuba Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 2 (Homo sapiens (Human))	BDBM50296881 ((1-((1R,4R)-4-((S)-2,2-difluoro-1-(4-methoxyphenyl...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human neuropeptide Y2 receptor expressed in HEK293 cells by [35S]GTPgammaS binding assay				Bioorg Med Chem Lett 19: 4781-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.050 BindingDB Entry DOI: 10.7270/Q2319VXR
Tsukuba Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50296881 ((1-((1R,4R)-4-((S)-2,2-difluoro-1-(4-methoxyphenyl...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]imipramine from human serotonin transporter expressed in CHO cell membrane by scintillation counting				Bioorg Med Chem Lett 19: 4781-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.050 BindingDB Entry DOI: 10.7270/Q2319VXR
Tsukuba Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Mus musculus (Mouse))	BDBM50296881 ((1-((1R,4R)-4-((S)-2,2-difluoro-1-(4-methoxyphenyl...) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Antagonist activity at mouse neuropeptide Y5 receptor expressed in HEK293 cells by [35S]GTPgammaS binding assay				Bioorg Med Chem Lett 19: 4781-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.050 BindingDB Entry DOI: 10.7270/Q2319VXR
Tsukuba Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50296881 ((1-((1R,4R)-4-((S)-2,2-difluoro-1-(4-methoxyphenyl...) 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	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [35S]MK499 from human ERG potassium channel expressed in HEK293 cells				Bioorg Med Chem Lett 19: 4781-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.050 BindingDB Entry DOI: 10.7270/Q2319VXR
Tsukuba Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 4 (Homo sapiens (Human))	BDBM50296881 ((1-((1R,4R)-4-((S)-2,2-difluoro-1-(4-methoxyphenyl...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human neuropeptide Y4 receptor expressed in HEK293 cells by [35S]GTPgammaS binding assay				Bioorg Med Chem Lett 19: 4781-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.050 BindingDB Entry DOI: 10.7270/Q2319VXR
Tsukuba Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair