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Binding of Arylpiperazines, (Aryloxy)propanolamines, and Tetrahydropyridylindoles to the 5-HT1A Receptor: Contribution of the Molecular Lipophilicity Potential to Three-Dimensional Quantitative Structure−Affinity Relationship Models

https://doi.org/10.1021/jm950410b
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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1007/bf00119860openalex-snapshot
Molecular Lipophilicity Potential, a tool in 3D QSAR: Method and applications
inferredcites →https://doi.org/10.1007/bf00135313openalex-snapshot
HINT: A new method of empirical hydrophobic field calculation for CoMFA
inferredcites →https://doi.org/10.1016/0014-2999(93)90416-fopenalex-snapshot
S 15535: a highly selective benzodioxopiperazine 5-HT1A receptor ligand which acts as an agonist and an antagonist at presynaptic and postsynaptic sites respectively
inferredcites →https://doi.org/10.1016/0014-2999(93)90453-oopenalex-snapshot
Evidence for a role of 5-HT1C receptors in the antiserotonergic properties of some antidepressant drugs
inferredcites →https://doi.org/10.1016/0040-4020(80)80168-2openalex-snapshot
Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges
inferredcites →https://doi.org/10.1016/0223-5234(89)90160-8openalex-snapshot
Radioligand binding study of a series of 5-HT1A receptor agonists and definition of a steric model of this site
inferredcites →https://doi.org/10.1016/0223-5234(90)90153-topenalex-snapshot
Advances in drug research
inferredcites →https://doi.org/10.1016/0922-4106(93)90061-dopenalex-snapshot
Structural analysis by the comparative molecular field analysis method of the affinity of β-adrenoreceptor blocking agents for 5-HT1A and 5-HT1B receptors
inferredcites →https://doi.org/10.1016/0958-1669(94)90054-xopenalex-snapshot
Locating ligand-binding sites in 7tm receptors by protein engineering
inferredcites →https://doi.org/10.1021/ja00226a005openalex-snapshot
Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins
inferredcites →https://doi.org/10.1021/jm00043a015openalex-snapshot
Structure-Affinity Relationship Studies on 5-HT1A receptor Ligands. 2. Heterobicyclic Phenylpiperazines with N4-Aralkyl Substituents
inferredcites →https://doi.org/10.1021/jm00053a009openalex-snapshot
On the prediction of binding properties of drug molecules by comparative molecular field analysis
inferredcites →https://doi.org/10.1021/jm00071a006openalex-snapshot
Structure-affinity relationship studies on 5-HT1A receptor ligands. 1. Heterobicyclic phenylpiperazines with N4-alkyl substituents
inferredcites →https://doi.org/10.1021/jm00077a003openalex-snapshot
Three-dimensional quantitative structure-activity relationships of 5-HT receptor binding data for tetrahydropyridinylindole derivatives: a comparison of the Hansch and CoMFA methods
inferredcites →https://doi.org/10.1021/jm00091a004openalex-snapshot
Structure-activity relationship studies of central nervous system (CNS) agents. 5. Effect of the hydrocarbon chain on the affinity of 4-substituted 1-(3-chlorophenyl)piperazines for 5-HT1A receptor sites
inferredcites →https://doi.org/10.1021/jm00091a005openalex-snapshot
Electrophilic opioid ligands. Oxygen-tethered .alpha.-methylene-.gamma.-lactone, acrylate, isothiocyanate, and epoxide derivatives of 6.beta.-naltrexol
inferredcites →https://doi.org/10.1021/jm00092a004openalex-snapshot
Comparative molecular field analysis of anticoccidial triazines
inferredcites →https://doi.org/10.1021/jm00124a021openalex-snapshot
Design and synthesis of propranolol analogs as serotonergic agents
inferredcites →https://doi.org/10.1021/jm00124a022openalex-snapshot
Conformationally restricted analogs of the muscarinic agent N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide
inferredcites →https://doi.org/10.1021/jm00128a039openalex-snapshot
N-(phthalimidoalkyl) derivatives of serotonergic agents: a common interaction at 5-HT1A serotonin binding sites?
inferredcites →https://doi.org/10.1021/jm00170a007openalex-snapshot
3-(1,2,5,6-Tetrahydropyrid-4-yl)pyrrolo[3,2-b]pyrid-5-one: a potent and selective serotonin (5-HT1*) agonist and rotationally restricted phenolic analog of 5-methoxy-3-(1,2,5,6-tetrahydropyrid-4-yl)indole
inferredcites →https://doi.org/10.1021/jm00401a007openalex-snapshot
Graphics computer-aided receptor mapping as a predictive tool for drug design: development of potent, selective, and stereospecific ligands for the 5-HT1A receptor
inferredcites →https://doi.org/10.1038/335358a0openalex-snapshot
The genomic clone G-21 which resembles a β-adrenergic receptor sequence encodes the 5-HT1A receptor
inferredcites →https://doi.org/10.1038/335360a0openalex-snapshot
Membrane potential has no direct role in evoking neurotransmitter release
inferredcites →https://doi.org/10.1080/10629369308029894openalex-snapshot
Use of the Hydrophobic Substituent Constant in a Comparative Molecular Field Analysis (CoMFA) on a Set of Anilides Inhibiting the Hill Reaction

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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Computational Approaches to Lipophilicity: Methods and Applications
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Structure‐Activity Relationship Studies of CNS Agents, Part 31[1]: Analogs of MP 3022 with a Different Number of Nitrogen Atoms in the Heteroaromatic Fragment — New 5‐HT1A Receptor Ligands
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Multitargeting in cardioprotection: An example of biaromatic compounds
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A comparative molecular field analysis (CoMFA) study using semiempirical, density functional, ab initio methods and pharmacophore derivation using DISCOtech on sigma 1 ligands
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Interpretation of QSAR Models Based on Random Forest Methods
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Building a Bridge between G-Protein-Coupled Receptor Modelling, Protein Crystallography and 3D QSAR Studies for Ligand Design
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Recent Progress in CoMFA Methodology and Related Techniques
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5-HT1A Receptors Mapping by Conformational Analysis (2D NOESY/MM) and “Three Way Modelling” (HASL, CoMFA, PARM)
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5-HT1A receptor pharmacophores to screen for off-target activity of α1-adrenoceptor antagonists
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Explainable QSAR models of 5-HT1A receptor ligands using conceptual DFT descriptors and no-code machine learning tools
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Integrating traditional QSAR and read-across-based regression models for predicting potential anti-leishmanial azole compounds
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3D-QSAR studies on glycogen phosphorylase inhibitors by flexible comparative molecular field analysis
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Signaling pathways of membrane-spanning receptors for drug development
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Pharmacophore models based studies on the affinity and selectivity toward 5-HT1A with reference to α1-adrenergic receptors among arylpiperazine derivatives of phenytoin
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A chemometric study of the 5-HT1A receptor affinities presented by arylpiperazine compounds
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GRIND-based 3D-QSAR and CoMFA to investigate topics dominated by hydrophobic interactions: The case of hERG K+ channel blockers
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Application of desirability-based multi(bi)-objective optimization in the design of selective arylpiperazine derivates for the 5-HT1A serotonin receptor
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Pharmacophore-based 3D QSAR studies on a series of high affinity 5-HT1A receptor ligands
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Drug permeation in biomembranes
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Interaction of the anxiogenic agent, RS-30199, with 5-HT1A receptors: modulation of sexual activity in the male rat
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Molecular fields in quantitative structure–permeation relationships: the VolSurf approach
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3D QSAR analysis of novel 5-HT1A receptor ligands
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High affinity central benzodiazepine receptor ligands. Part 2: quantitative structure–activity relationships and comparative molecular field analysis of pyrazolo[4,3-c]quinolin-3-ones
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How do antibodies and lectins recognize histo-blood group antigens? A 3D-QSAR study by comparative molecular field analysis (CoMFA)
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Ligand binding to I2 imidazoline receptor: The role of lipophilicity in quantitative structure—activity relationship models
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Comparative molecular field analysis of some pyridazinone-containing α1-Antagonists
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From Homology Models to a Set of Predictive Binding Pockets–a 5-HT1A Receptor Case Study
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Interpretation of Quantitative Structure–Activity Relationship Models: Past, Present, and Future
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NGT: Generative AI with Synthesizability Guarantees Discovers MC2R Inhibitors from a Tera-Scale Virtual Screen
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Quantitative Structure–Activity Relationship for High Affinity 5-HT1A Receptor Ligands Based on Norm Indexes
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Synthesis, Biological Evaluation, and Pharmacophore Generation of New Pyridazinone Derivatives with Affinity toward α1- and α2-Adrenoceptors
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Synthesis and Pharmacological Evaluation of 1-[(1,2-Diphenyl-1H-4-imidazolyl)methyl]-4-phenylpiperazines with Clozapine-Like Mixed Activities at Dopamine D2, Serotonin, and GABAAReceptors
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Pharmacophoric Search and 3D-QSAR Comparative Molecular Field Analysis Studies on Agonists of Melatonin Sheep Receptors
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Antitumor Agents. 199. Three-Dimensional Quantitative Structure−Activity Relationship Study of the Colchicine Binding Site Ligands Using Comparative Molecular Field Analysis
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3D-QSAR using `Multiconformer' alignment: The use of HASL in the analysis of 5-HT1A thienopyrimidinone ligands†
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Localization and quantification of hydrophobicity: The molecular free energy density (MolFESD) concept and its application to sweetness recognition
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Recent progress in CoMFA methodology and related techniques
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Building a bridge between G-protein-coupled receptor modelling, protein crystallography and 3D QSAR studies for ligand design
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Modelagem molecular de compostos arilpiperazínicos e suas interações com o receptor 5-HT1A
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柔性比较分子场分析方法在糖原磷酸化酶抑制剂三维定量构效关系研究中的应用
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In Silico Studies Targeting G-protein Coupled Receptors for Drug Research Against Parkinson’s Disease
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Biologically Active 1-Arylpiperazines. Synthesis of New N-(4-Aryl-1-piperazinyl)alkyl Derivatives of Quinazolidin-4(3H)-one, 2,3-Dihydrophthalazine-1,4-dione and 1,2-Dihydropyridazine-3,6-dione as Potential Serotonin Receptor Ligands
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ZASTOSOWANIE METOD OBLICZENIOWYCH DO WYZNACZANIA BUDOWY MODELI FARMAKOFOROWYCH RECEPTORÓW 5-HT1A, 5-HT2A ORAZ 5-HT7
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