BindingDB PrimarySearch

BDBM50263856 5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H-1,2,4-triazol-4-yl)-2-methoxypyridine::CHEMBL492029

SMILES: CCOCc1nnc(-c2ccc(OCC)c(C)c2)n1-c1ccc(OC)nc1

InChI Key: InChIKey=CMWAFGVDYAWHSS-UHFFFAOYSA-N

Data: 8 KI

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50263856
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
Oxytocin receptor (Homo sapiens (Human))	BDBM50263856 (5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Antagonist activity at human oxytocin receptor by cell based beta-lactamase reporter gene assay				Bioorg Med Chem Lett 18: 5242-4 (2008) Article DOI: 10.1016/j.bmcl.2008.08.066 BindingDB Entry DOI: 10.7270/Q2833RVK
Pfizer Global Research and Development Curated by ChEMBL					More data for this Ligand-Target Pair
Oxytocin receptor (Homo sapiens (Human))	BDBM50263856 (5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DrugMolDesign Curated by ChEMBL					Assay Description Displacement of [3H]-oxytocin from human oxytocin receptor expressed in HEK293-EBNA cells				J Med Chem 53: 6525-38 (2010) Article DOI: 10.1021/jm901812z BindingDB Entry DOI: 10.7270/Q20R9PMZ
DrugMolDesign Curated by ChEMBL					More data for this Ligand-Target Pair
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM50263856 (5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H...) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	549	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DrugMolDesign Curated by ChEMBL					Assay Description Displacement of [3H]-vasopressin from human vasopressin V1a receptor expressed in CHO cells at 10 uM				J Med Chem 53: 6525-38 (2010) Article DOI: 10.1021/jm901812z BindingDB Entry DOI: 10.7270/Q20R9PMZ
DrugMolDesign Curated by ChEMBL					More data for this Ligand-Target Pair
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM50263856 (5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H...) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	594	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Antagonist activity at human vasopressin V1a receptor by cell based beta-lactamase reporter gene assay				Bioorg Med Chem Lett 18: 5242-4 (2008) Article DOI: 10.1016/j.bmcl.2008.08.066 BindingDB Entry DOI: 10.7270/Q2833RVK
Pfizer Global Research and Development Curated by ChEMBL					More data for this Ligand-Target Pair
Vasopressin V1b receptor (Homo sapiens (Human))	BDBM50263856 (5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H...) Show SMILES Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DrugMolDesign Curated by ChEMBL					Assay Description Displacement of [3H]-vasopressin from human vasopressin V1b receptor expressed in CHO cells				J Med Chem 53: 6525-38 (2010) Article DOI: 10.1021/jm901812z BindingDB Entry DOI: 10.7270/Q20R9PMZ
DrugMolDesign Curated by ChEMBL					More data for this Ligand-Target Pair
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM50263856 (5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H...) Show SMILES Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DrugMolDesign Curated by ChEMBL					Assay Description Displacement of [3H]-vasopressin from human vasopressin V2 receptor expressed in CHO cells				J Med Chem 53: 6525-38 (2010) Article DOI: 10.1021/jm901812z BindingDB Entry DOI: 10.7270/Q20R9PMZ
DrugMolDesign Curated by ChEMBL					More data for this Ligand-Target Pair
Vasopressin V1b receptor (Homo sapiens (Human))	BDBM50263856 (5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H...) Show SMILES Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Antagonist activity at human vasopressin V1b receptor by cell based beta-lactamase reporter gene assay				Bioorg Med Chem Lett 18: 5242-4 (2008) Article DOI: 10.1016/j.bmcl.2008.08.066 BindingDB Entry DOI: 10.7270/Q2833RVK
Pfizer Global Research and Development Curated by ChEMBL					More data for this Ligand-Target Pair
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM50263856 (5-(3-(4-ethoxy-3-methylphenyl)-5-(ethoxymethyl)-4H...) Show SMILES Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Antagonist activity at human vasopressin V2 receptor by cell based beta-lactamase reporter gene assay				Bioorg Med Chem Lett 18: 5242-4 (2008) Article DOI: 10.1016/j.bmcl.2008.08.066 BindingDB Entry DOI: 10.7270/Q2833RVK
Pfizer Global Research and Development Curated by ChEMBL					More data for this Ligand-Target Pair