BindingDB PrimarySearch

BDBM50336912 Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamoyl-2-phenyl-ethylcarbamoyl)-4-guanidino-butyl]-amide::CHEMBL1672380

SMILES: [#7]\[#6](-[#7])=[#7]/[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)C12[#6]-[#6]-3-[#6]-[#6](-[#6]-[#6](-[#6]-3)-[#6]1)-[#6]2)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#7])=O

InChI Key: InChIKey=UMKHUSRDQFQHAK-RNJMTYCLSA-N

Data: 2 KI 3 IC50 5 EC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50336912
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
Neuropeptide FF receptor 1 (Homo sapiens (Human))	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	Reactome pathway KEGG 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
University of Strasbourg Curated by ChEMBL					Assay Description Displacement of [3H]FFRF-NH2 from human flag-tagged NPFF1 receptor expressed in CHO cells by scintillation counting				Bioorg Med Chem Lett 22: 7471-4 (2012) Article DOI: 10.1016/j.bmcl.2012.10.049 BindingDB Entry DOI: 10.7270/Q2FF3THX
University of Strasbourg Curated by ChEMBL					More data for this Ligand-Target Pair
NPFF2 (Homo sapiens (Human))	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	43	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Strasbourg Curated by ChEMBL					Assay Description Displacement of [3H]FFRF-NH2 from human flag-tagged NPFF2 receptor expressed in CHO cells by scintillation counting				Bioorg Med Chem Lett 22: 7471-4 (2012) Article DOI: 10.1016/j.bmcl.2012.10.049 BindingDB Entry DOI: 10.7270/Q2FF3THX
University of Strasbourg Curated by ChEMBL					More data for this Ligand-Target Pair
NPFF2 (Homo sapiens (Human))	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
Lanzhou University Curated by ChEMBL					Assay Description Antagonist activity at NPFF2 receptor (unknown origin) expressed in HEK293A cells assessed as reversal of NPPF induced inhibition of forskolin-stimul...				Bioorg Med Chem 27: 630-643 (2019) Article DOI: 10.1016/j.bmc.2019.01.003
Lanzhou University Curated by ChEMBL					More data for this Ligand-Target Pair
Mas-related G-protein coupled receptor member X1 (Mus musculus)	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	KEGG GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	316	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Agonist activity at mouse MrgC11 transfected in HEK293 cells by FLIPR assay				Bioorg Med Chem 22: 5831-7 (2014) Article DOI: 10.1016/j.bmc.2014.09.025 BindingDB Entry DOI: 10.7270/Q27P92CV
Johns Hopkins University Curated by ChEMBL					More data for this Ligand-Target Pair
Mas-related G-protein coupled receptor member X1 (Homo sapiens (Human))	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	KEGG GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	<1.00E+5	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Agonist activity at human MrgX1 transfected in HEK293 cells by FLIPR assay				Bioorg Med Chem 22: 5831-7 (2014) Article DOI: 10.1016/j.bmc.2014.09.025 BindingDB Entry DOI: 10.7270/Q27P92CV
Johns Hopkins University Curated by ChEMBL					More data for this Ligand-Target Pair
Mas-related G-protein coupled receptor member X1 (Rattus norvegicus)	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	Reactome pathway KEGG DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	6.31E+3	n/a	n/a	n/a	n/a
Johns Hopkins University Curated by ChEMBL					Assay Description Agonist activity at rat MrgX1 transfected in HEK293 cells by FLIPR assay				Bioorg Med Chem 22: 5831-7 (2014) Article DOI: 10.1016/j.bmc.2014.09.025 BindingDB Entry DOI: 10.7270/Q27P92CV
Johns Hopkins University Curated by ChEMBL					More data for this Ligand-Target Pair
Neuropeptide FF receptor 1 (Homo sapiens (Human))	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	Reactome pathway KEGG GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
Lanzhou University Curated by ChEMBL					Assay Description Antagonist activity at NPFF1 receptor (unknown origin) expressed in HEK293A cells assessed as reversal of NPPF induced inhibition of forskolin-stimul...				Bioorg Med Chem 27: 630-643 (2019) Article DOI: 10.1016/j.bmc.2019.01.003
Lanzhou University Curated by ChEMBL					More data for this Ligand-Target Pair
Neuropeptide FF receptor 1 (Homo sapiens (Human))	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	Reactome pathway KEGG GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	71	n/a	n/a	n/a	n/a
Leipzig University Curated by ChEMBL					Assay Description Agonist activity at human NPFF1 receptor expressed in COS1 cells assessed as [3H]inositol phosphate accumulation after 2 hrs by liquid scintillation ...				J Med Chem 55: 6124-36 (2012) Article DOI: 10.1021/jm300535s BindingDB Entry DOI: 10.7270/Q26974PV
Leipzig University Curated by ChEMBL					More data for this Ligand-Target Pair
NPFF2 (Homo sapiens (Human))	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	379	n/a	n/a	n/a	n/a
Leipzig University Curated by ChEMBL					Assay Description Agonist activity at human NPFF2 receptor expressed in COS1 cells assessed as [3H]inositol phosphate accumulation after 2 hrs by liquid scintillation ...				J Med Chem 55: 6124-36 (2012) Article DOI: 10.1021/jm300535s BindingDB Entry DOI: 10.7270/Q26974PV
Leipzig University Curated by ChEMBL					More data for this Ligand-Target Pair
G-protein Coupled Receptor 54 (Homo sapiens (Human))	BDBM50336912 (Adamantane-1-carboxylic acid [(S)-1-((S)-1-carbamo...) Show SMILES Show InChI	Reactome pathway KEGG GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	830	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of [125I]kisspeptin-15 from GPR54				ACS Med Chem Lett 2: 53-57 (2011) Article DOI: 10.1021/ml1002053 BindingDB Entry DOI: 10.7270/Q2K07586
TBA Curated by ChEMBL					More data for this Ligand-Target Pair