BDBM50263912 5-(3-(3-chloro-4-ethoxyphenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-4-yl)-2-methoxypyridine::CHEMBL489386

SMILES: CCOc1ccc(cc1Cl)-c1nnc(COC)n1-c1ccc(OC)nc1

InChI Key: InChIKey=ATFKUEIQKWUBJO-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 50263912   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Oxytocin receptor (Homo sapiens (Human))	BDBM50263912 (5-(3-(3-chloro-4-ethoxyphenyl)-5-(methoxymethyl)-4...) Show SMILES CCOc1ccc(cc1Cl)-c1nnc(COC)n1-c1ccc(OC)nc1 Show InChI InChI=1S/C18H19ClN4O3/c1-4-26-15-7-5-12(9-14(15)19)18-22-21-16(11-24-2)23(18)13-6-8-17(25-3)20-10-13/h5-10H,4,11H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	144	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
					More data for this Ligand-Target Pair
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM50263912 (5-(3-(3-chloro-4-ethoxyphenyl)-5-(methoxymethyl)-4...) Show SMILES CCOc1ccc(cc1Cl)-c1nnc(COC)n1-c1ccc(OC)nc1 Show InChI InChI=1S/C18H19ClN4O3/c1-4-26-15-7-5-12(9-14(15)19)18-22-21-16(11-24-2)23(18)13-6-8-17(25-3)20-10-13/h5-10H,4,11H2,1-3H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.90E+3	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
					More data for this Ligand-Target Pair
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM50263912 (5-(3-(3-chloro-4-ethoxyphenyl)-5-(methoxymethyl)-4...) Show SMILES CCOc1ccc(cc1Cl)-c1nnc(COC)n1-c1ccc(OC)nc1 Show InChI InChI=1S/C18H19ClN4O3/c1-4-26-15-7-5-12(9-14(15)19)18-22-21-16(11-24-2)23(18)13-6-8-17(25-3)20-10-13/h5-10H,4,11H2,1-3H3	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
					More data for this Ligand-Target Pair