SMILES String Search

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 289.4
BDBM73402

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 13 hits in this display
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Muscarinic acetylcholine receptor M1 (RAT)	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase 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
Virginia Commonwealth University Curated by ChEMBL					Assay Description Displacement of [3H]pirenzepine from muscarinic acetylcholine receptor M1 in rat cortex homogenates				J Med Chem 34: 2984-9 (1991) BindingDB Entry DOI: 10.7270/Q27H1K5M
Virginia Commonwealth University Curated by ChEMBL					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (RAT)	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase 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
Albany Molecular Research Curated by ChEMBL					Assay Description Binding affinity was measured against muscarinic (M1) receptor in rat using [3H]pirenzepine as radioligand				J Med Chem 37: 1964-70 (1994) BindingDB Entry DOI: 10.7270/Q2QZ2BMR
Albany Molecular Research Curated by ChEMBL					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NIDA-IRP Curated by ChEMBL					Assay Description Binding affinity against Sigma receptor type 1 was determined by the displacement of [3H]pentazocine radioligand				J Med Chem 46: 2589-98 (2003) Article DOI: 10.1021/jm030008u BindingDB Entry DOI: 10.7270/Q2H70GJN
NIDA-IRP Curated by ChEMBL					More data for this Ligand-Target Pair
Lysosomal Pro-X carboxypeptidase (Homo sapiens (Human))	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago 60607-7061 Curated by ChEMBL					Assay Description Inhibition of [3H]- (+) - pentazocine binding to PCP receptor obtained from tissue homogenate preparation of fresh whole rat brain minus cerebellum				J Med Chem 41: 468-77 (1998) Article DOI: 10.1021/jm970059p BindingDB Entry DOI: 10.7270/Q27W6CW7
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Albany Molecular Research Curated by ChEMBL					Assay Description The compound was evaluated for affinity at sigma-1 site by inhibition of [3H](+)-pentazocine (PENT) binding in guinea pig brain.				J Med Chem 37: 1964-70 (1994) BindingDB Entry DOI: 10.7270/Q2QZ2BMR
Albany Molecular Research Curated by ChEMBL					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Displacement of [3H](-)-quinuclidinyl benzilate(QNB) from muscarinic (M2) receptor in rat heart homogenates				J Med Chem 34: 2984-9 (1991) BindingDB Entry DOI: 10.7270/Q27H1K5M
Virginia Commonwealth University Curated by ChEMBL					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (RAT)	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Albany Molecular Research Curated by ChEMBL					Assay Description Binding affinity was measured against muscarinic (M2) receptor in rat using [3H]QN as radioligand				J Med Chem 37: 1964-70 (1994) BindingDB Entry DOI: 10.7270/Q2QZ2BMR
Albany Molecular Research Curated by ChEMBL					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Albany Molecular Research Curated by ChEMBL					Assay Description Binding affinity was measured against dopamine (D2) receptor in rat using [3H]spiperone as radioligand				J Med Chem 37: 1964-70 (1994) BindingDB Entry DOI: 10.7270/Q2QZ2BMR
Albany Molecular Research Curated by ChEMBL					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Albany Molecular Research Curated by ChEMBL					Assay Description Binding affinity was measured against dopamine receptor D1 in rat using [3H]SCH-23390 as radioligand				J Med Chem 37: 1964-70 (1994) BindingDB Entry DOI: 10.7270/Q2QZ2BMR
Albany Molecular Research Curated by ChEMBL					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.18E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NIDA-IRP Curated by ChEMBL					Assay Description Binding affinity against dopamine transporter was determined by the displacement of [3H]WIN-35428 radioligand in rat brain				J Med Chem 46: 2589-98 (2003) Article DOI: 10.1021/jm030008u BindingDB Entry DOI: 10.7270/Q2H70GJN
NIDA-IRP Curated by ChEMBL					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.25E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse-Intramural Research Program Curated by ChEMBL					Assay Description Binding affinity to dopamine transporter (DAT) using [3H]WIN-35428 as a radioligand				J Med Chem 43: 4151-9 (2000) Article DOI: 10.1021/jm990472s BindingDB Entry DOI: 10.7270/Q2PK0JWZ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (GUINEA PIG)	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Discovery Research Curated by PDSP K_i Database									J Pharmacol Exp Ther 267: 961-70 (1993) BindingDB Entry DOI: 10.7270/Q2125R5V
Syntex Discovery Research Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Protein LANA1 (Human herpesvirus 8)	BDBM73402 (1-Phenyl-cyclopentanecarboxylic acid 2-diethylamin...) Show SMILES CCN(CC)CCOC(=O)C1(CCCC1)c1ccccc1 Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>7.50E+4	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Primary Collaborators: Kenneth Kaye,Brigham & Womens,Boston MA,kkaye@rics.bwh.harvard.edu,617-525-4256 Chantal Beauchemin,Brigham & Womens,Boston MA,...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2HH6HHN
Broad Institute Curated by PubChem BioAssay					More data for this Ligand-Target Pair