BDBM50304083 3-(3-((Dimethylamino)methyl)-5-(2,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl)phenol::CHEMBL596371

SMILES: CN(C)Cc1nc(-c2ccc(C)cc2C)n(n1)-c1cccc(O)c1

InChI Key: InChIKey=QSSZOJFXUSHIGB-UHFFFAOYSA-N

Data: 3 IC50

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 = 50304083   

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
Mu-type opioid receptor (MOUSE)	BDBM50304083 (3-(3-((Dimethylamino)methyl)-5-(2,4-dimethylphenyl...) Show SMILES CN(C)Cc1nc(-c2ccc(C)cc2C)n(n1)-c1cccc(O)c1 Show InChI InChI=1S/C19H22N4O/c1-13-8-9-17(14(2)10-13)19-20-18(12-22(3)4)21-23(19)15-6-5-7-16(24)11-15/h5-11,24H,12H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Medicine and Dentistry of New Jersey-Robert Wood Johnson Medical School and the Informatics Institute of UMDNJ Curated by ChEMBL					Assay Description Displacement of [3H]bremazocine from mouse mu opioid receptor expressed in HEK293 cells by liquid scintillation counting				Bioorg Med Chem 17: 6442-50 (2009) Article DOI: 10.1016/j.bmc.2009.07.007 BindingDB Entry DOI: 10.7270/Q2QZ2B14
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50304083 (3-(3-((Dimethylamino)methyl)-5-(2,4-dimethylphenyl...) Show SMILES CN(C)Cc1nc(-c2ccc(C)cc2C)n(n1)-c1cccc(O)c1 Show InChI InChI=1S/C19H22N4O/c1-13-8-9-17(14(2)10-13)19-20-18(12-22(3)4)21-23(19)15-6-5-7-16(24)11-15/h5-11,24H,12H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	273	n/a	n/a	n/a	n/a	n/a	n/a
University of Medicine and Dentistry of New Jersey-Robert Wood Johnson Medical School and the Informatics Institute of UMDNJ Curated by ChEMBL					Assay Description Displacement of [3H]bremazocine from mouse delta opioid receptor expressed in HEK293 cells by liquid scintillation counting				Bioorg Med Chem 17: 6442-50 (2009) Article DOI: 10.1016/j.bmc.2009.07.007 BindingDB Entry DOI: 10.7270/Q2QZ2B14
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Rattus norvegicus (rat))	BDBM50304083 (3-(3-((Dimethylamino)methyl)-5-(2,4-dimethylphenyl...) Show SMILES CN(C)Cc1nc(-c2ccc(C)cc2C)n(n1)-c1cccc(O)c1 Show InChI InChI=1S/C19H22N4O/c1-13-8-9-17(14(2)10-13)19-20-18(12-22(3)4)21-23(19)15-6-5-7-16(24)11-15/h5-11,24H,12H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	351	n/a	n/a	n/a	n/a	n/a	n/a
University of Medicine and Dentistry of New Jersey-Robert Wood Johnson Medical School and the Informatics Institute of UMDNJ Curated by ChEMBL					Assay Description Displacement of [3H]bremazocine from rat kappa opioid receptor expressed in HEK293 cells by liquid scintillation counting				Bioorg Med Chem 17: 6442-50 (2009) Article DOI: 10.1016/j.bmc.2009.07.007 BindingDB Entry DOI: 10.7270/Q2QZ2B14
					More data for this Ligand-Target Pair