BindingDB PrimarySearch

BDBM50060073 2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-propionyl]-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid amide::2-[2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-propionyl]-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid amide::2-[2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-(2S)-propanoyl]-1,2,3,4-tetrahydro-3-isoquinolinecarboxamide::CHEMBL93041

SMILES: Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1Cc2ccccc2CC1C(N)=O

InChI Key: InChIKey=RXAGYENDHOXBOY-OYKVQYDMSA-N

Data: 6 KI 1 EC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50060073
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
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50060073 (2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-p...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Ferrara Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 by displacement of [3H]- DPDPE				J Med Chem 40: 3100-8 (1997) Article DOI: 10.1021/jm9607663 BindingDB Entry DOI: 10.7270/Q2TD9Z1N
University of Ferrara Curated by ChEMBL					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50060073 (2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-p...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibitory concentration against Opioid receptor delta 1 in mouse vas deferens using competition binding assay				Bioorg Med Chem Lett 10: 2745-8 (2000) BindingDB Entry DOI: 10.7270/Q25H7HF1
University of Naples Curated by ChEMBL					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50060073 (2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-p...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Cagliary Curated by ChEMBL					Assay Description Binding affinity at Opioid receptor delta 1 using rat brain receptor (P2 synaptosome) assay				J Med Chem 45: 713-20 (2002) BindingDB Entry DOI: 10.7270/Q2639QFF
University of Cagliary Curated by ChEMBL					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50060073 (2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-p...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	277	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Ferrara Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 by displacement of [3H]- DAGO				J Med Chem 40: 3100-8 (1997) Article DOI: 10.1021/jm9607663 BindingDB Entry DOI: 10.7270/Q2TD9Z1N
University of Ferrara Curated by ChEMBL					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50060073 (2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-p...) Show SMILES Show InChI	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	277	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of guinea pig ileum Opioid receptor mu 1				Bioorg Med Chem Lett 10: 2745-8 (2000) BindingDB Entry DOI: 10.7270/Q25H7HF1
University of Naples Curated by ChEMBL					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50060073 (2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-p...) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.77E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Cagliary Curated by ChEMBL					Assay Description Binding affinity for rat brain P2 synaptosome Opioid receptor mu 1				J Med Chem 45: 713-20 (2002) BindingDB Entry DOI: 10.7270/Q2639QFF
University of Cagliary Curated by ChEMBL					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50060073 (2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-p...) Show SMILES Show InChI	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Negative logarithm of the molar concentration for agonist activity at Opioid receptor mu 1 was determined in guinea pig ileum				Bioorg Med Chem Lett 10: 2745-8 (2000) BindingDB Entry DOI: 10.7270/Q25H7HF1
University of Naples Curated by ChEMBL					More data for this Ligand-Target Pair