BDBM50026752 1-Methyl-4-phenyl-piperidine-4-carboxylic acid ethyl ester::1-Methyl-4-phenyl-piperidine-4-carboxylic acid ethyl ester(Meperidine)::4-Ethoxycarbonyl-1-methyl-4-phenyl-piperidinium::CHEMBL607::Demerol::MEPERIDINE::MEPERIDINE HYDROCHLORIDE::Mepergan::Pethidine::ethyl 1-methyl-4-phenylpiperidine-4-carboxylate
SMILES: CCOC(=O)C1(CCN(C)CC1)c1ccccc1
InChI Key: InChIKey=XADCESSVHJOZHK-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sodium-dependent serotonin transporter (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | 412 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of New Orleans Curated by ChEMBL | Assay Description Displacement of [3H]-paroxetine from serotonin transporter (SERT) | Bioorg Med Chem Lett 9: 3273-6 (2000) Article DOI: 10.1016/s0960-894x(99)00606-x BindingDB Entry DOI: 10.7270/Q23F4NVM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent serotonin transporter (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | 413 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of New Orleans Curated by ChEMBL | Assay Description Inhibition of [3H]paroxetine binding to rat serotonin transporter | J Med Chem 48: 1336-43 (2005) Article DOI: 10.1021/jm0401614 BindingDB Entry DOI: 10.7270/Q2PZ59KQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent serotonin transporter (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | 413 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of New Orleans Curated by ChEMBL | Assay Description Displacement of [3H]citalopram from serotonin transporter in Sprague-Dawley rat brain after 1 hr by liquid scintillation counting | Bioorg Med Chem 18: 8356-64 (2010) Article DOI: 10.1016/j.bmc.2010.09.060 BindingDB Entry DOI: 10.7270/Q2CN744P | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (GUINEA PIG) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | 451 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University Curated by ChEMBL | Assay Description Binding affinity of the compound against mu opioid receptor was determined in brain membrane preparations from male Hartley guinea-pigs | Bioorg Med Chem Lett 8: 1813-8 (1999) Article DOI: 10.1016/s0960-894x(98)00318-7 BindingDB Entry DOI: 10.7270/Q2K073D5 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | DrugBank Article PubMed | 920 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of New Orleans Curated by ChEMBL | Assay Description Binding affinity at mu-opioid receptor | Bioorg Med Chem 18: 8356-64 (2010) Article DOI: 10.1016/j.bmc.2010.09.060 BindingDB Entry DOI: 10.7270/Q2CN744P | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | DrugBank Article PubMed | 920 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of New Orleans Curated by ChEMBL | Assay Description Inhibition of [3H]DAMGO binding to mu-opioid receptor | J Med Chem 48: 1336-43 (2005) Article DOI: 10.1021/jm0401614 BindingDB Entry DOI: 10.7270/Q2PZ59KQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent dopamine transporter (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | 1.78E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of New Orleans Curated by ChEMBL | Assay Description Displacement of [3H]WIN 35428 from dopamine transporter in Sprague-Dawley rat brain after 1 hr by liquid scintillation counting | Bioorg Med Chem 18: 8356-64 (2010) Article DOI: 10.1016/j.bmc.2010.09.060 BindingDB Entry DOI: 10.7270/Q2CN744P | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent dopamine transporter (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | 1.78E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of New Orleans Curated by ChEMBL | Assay Description Inhibition of [3H]WIN-35428 binding to rat dopamine transporter | J Med Chem 48: 1336-43 (2005) Article DOI: 10.1021/jm0401614 BindingDB Entry DOI: 10.7270/Q2PZ59KQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent dopamine transporter (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | 1.78E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of New Orleans Curated by ChEMBL | Assay Description Displacement of [3H]-WIN- 35,428 from dopamine transporter (DAT) | Bioorg Med Chem Lett 9: 3273-6 (2000) Article DOI: 10.1016/s0960-894x(99)00606-x BindingDB Entry DOI: 10.7270/Q23F4NVM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Taiwan University Curated by ChEMBL | Assay Description Binding affinity of the compound against Opioid receptor kappa 1 was determined in brain membrane preparations from male Hartley guinea-pigs | Bioorg Med Chem Lett 8: 1813-8 (1999) Article DOI: 10.1016/s0960-894x(98)00318-7 BindingDB Entry DOI: 10.7270/Q2K073D5 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | DrugBank Article PubMed | n/a | n/a | 315 | n/a | n/a | n/a | n/a | n/a | n/a |
Universities of Lille Curated by ChEMBL | Assay Description Binding affinity against mu-opiate receptor (human) using [3H]DAMGO radioligand | J Med Chem 44: 3378-90 (2001) Article DOI: 10.1021/jm010877o BindingDB Entry DOI: 10.7270/Q23X87B8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | DrugBank Article PubMed | n/a | n/a | n/a | n/a | 9.40E+3 | n/a | n/a | n/a | n/a |
University of Toronto Curated by ChEMBL | Assay Description Activity at human cloned mu opioid receptor assessed as reversal of DAMGO-induced [35S]GTPgammaS binding | Bioorg Med Chem Lett 19: 1228-32 (2009) Article DOI: 10.1016/j.bmcl.2008.12.095 BindingDB Entry DOI: 10.7270/Q2GT5N2W | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Delta-type opioid receptor (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universities of Lille Curated by ChEMBL | Assay Description Binding affinity against delta-opiate receptor (human) using [3H]-DPDPE radioligand | J Med Chem 44: 3378-90 (2001) Article DOI: 10.1021/jm010877o BindingDB Entry DOI: 10.7270/Q23X87B8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Solute carrier family 22 member 1 (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | Reactome pathway UniProtKB/SwissProt antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.23E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University Medicine Greifswald Curated by ChEMBL | Assay Description Inhibition of human OCT1 expressed in HEK293 cells assessed as reduction in ASP+ substrate uptake by microplate reader based analysis | J Med Chem 62: 9890-9905 (2019) Article DOI: 10.1021/acs.jmedchem.9b01301 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 7.41E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TCG Lifesciences Ltd. Curated by ChEMBL | Assay Description Inhibition of human ERG | Eur J Med Chem 46: 618-30 (2011) Article DOI: 10.1016/j.ejmech.2010.11.042 BindingDB Entry DOI: 10.7270/Q2WQ052W | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 324 | n/a | n/a | n/a | n/a | n/a | n/a |
Reverse proteomics research institute Curated by ChEMBL | Assay Description Inhibitory concentration against potassium channel HERG | Bioorg Med Chem Lett 15: 2886-90 (2005) Article DOI: 10.1016/j.bmcl.2005.03.080 BindingDB Entry DOI: 10.7270/Q29S1S7C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 7.59E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Pisa Curated by ChEMBL | Assay Description Inhibition of human ERG channel in HEK293 cells by voltage-clamp method | Eur J Med Chem 43: 2479-88 (2008) Article DOI: 10.1016/j.ejmech.2007.12.025 BindingDB Entry DOI: 10.7270/Q2542PTB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptors; mu/kappa/delta (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB Reactome pathway UniProtKB/SwissProt DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of Opioid receptors binding by inhibiting specific [3H]naloxone binding by 50% in the presence of 100 mM NaCl | J Med Chem 23: 985-90 (1980) Article DOI: 10.1021/jm00183a005 BindingDB Entry DOI: 10.7270/Q2HD7XT0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptors; mu/kappa/delta (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB Reactome pathway UniProtKB/SwissProt DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of Opioid receptors with [3H]naloxone binding in the absence of NaCl | J Med Chem 23: 985-90 (1980) Article DOI: 10.1021/jm00183a005 BindingDB Entry DOI: 10.7270/Q2HD7XT0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptor (Rattus norvegicus (rat)-RAT) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of [3H]naloxone receptor binding to opioid receptor in the absence of NaCl | J Med Chem 29: 531-7 (1986) Article DOI: 10.1021/jm00154a018 BindingDB Entry DOI: 10.7270/Q2WH2QKX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptor (Rattus norvegicus (rat)-RAT) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 8.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of [3H]naloxone receptor binding to opioid receptor in the presence of 100 mM NaCl | J Med Chem 29: 531-7 (1986) Article DOI: 10.1021/jm00154a018 BindingDB Entry DOI: 10.7270/Q2WH2QKX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptor (Mus musculus (Mouse)-MOUSE) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Duphar Research Laboratories Curated by ChEMBL | Assay Description Tested for displacement of radioligand [3H]-Naloxone from opiate receptor | J Med Chem 36: 2751-60 (1993) Article DOI: 10.1021/jm00071a006 BindingDB Entry DOI: 10.7270/Q2CZ367F | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptor (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | n/a | n/a | 700 | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of radiolabeled dihydromorphine from opioid receptor in rat brain homogenates | J Med Chem 22: 889-90 (1979) Article DOI: 10.1021/jm00193a028 BindingDB Entry DOI: 10.7270/Q2QZ2DXM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptor (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of [3H]naloxone from Sprague-Dawley rat cerebellum opioid receptor assessed as relative receptor affinity by scintillation counting | J Med Chem 21: 600-6 (1978) Article DOI: 10.1021/jm00205a003 BindingDB Entry DOI: 10.7270/Q2WM1HDV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptor (Rattus norvegicus (rat)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB UniProtKB/SwissProt GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.00E+8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of [3H]naloxone from Sprague-Dawley rat cerebellum opioid receptor assessed as relative receptor affinity by scintillation counting | J Med Chem 21: 600-6 (1978) Article DOI: 10.1021/jm00205a003 BindingDB Entry DOI: 10.7270/Q2WM1HDV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Kappa-type opioid receptor (Homo sapiens (Human)) | BDBM50026752 (1-Methyl-4-phenyl-piperidine-4-carboxylic acid eth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars | DrugBank Article PubMed | n/a | n/a | 2.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universities of Lille Curated by ChEMBL | Assay Description Binding affinity against opioid receptor kappa 1 using [3H]- U-69,593 radioligand | J Med Chem 44: 3378-90 (2001) Article DOI: 10.1021/jm010877o BindingDB Entry DOI: 10.7270/Q23X87B8 | |||||||||||
More data for this Ligand-Target Pair |