Latest posts tagged with #ADME on Bluesky
Accelerate Your Drug Transport Research with #Cell4Pharma Vesicular Transport #Assay Kits!
🔗 https://www.stratech.co.uk/our-partners/cell4pharma/
🔬 Available for key transporters: P-gp, BSEP, MRP family, BCRP.
📦 Order now & take your ADME studies to the next level!
#DrugDiscovery #Pharmacology #ADME
If you’re working on gut #NAMs, #tox, or #ADME and wondering which platform to pick (or how to tune your media), we hope this gives a practical roadmap.
And if you made it this far, thanks for reading – happy to answer questions! 👇
#AssayInspector: a must-have open tool to assess the risk of directly aggregating data from different sources before constructing ML models.
Full article:
📖 jcheminf.biomedcentral.com/articles/10....
#DataQuality #DataIntegration #DataHeterogeneity #ModelQuality #ADME #PreclinicalSafety #NAMs
And Part II of our Metabolite Identification (MetID) Data in Drug Discovery is out: pubs.acs.org/doi/10.1021/... Here we explore application of MetID proprietary data to expand the capacity of site-of-metabolism (SoM) #ML models. The paper and SoM data are both #openacess.
#Zenodo #ADME
🚀 New J. Med. Chem. study: Linker methylation boosts oral bioavailability of VHL-PROTACs.
📊 #alvaDesc linked chemical space to PK for smarter design in #bRo5.
📄 Read the paper: doi.org/10.1021/acs....
🔗 Check alvaDesc at: alvascience.com/alvadesc/
#DrugDiscovery #PROTAC #ADME #chemsky
#Thiosemicarbazones (TSCs) stand out for their structural diversity, bioactivity, & ion-sensing potential🧪 In our Account by Tahmeena Khan & co-workers, tweaking molecular weight, benzene rings, and functional groups can boost #ADME & bioactivity scores.
👉 buff.ly/tPHyu2Q
Have you noticed a discrepancy in compound turnover between liver microsomes and hepatocytes, with accelerated degradation observed in hepatocyte incubations? This could be due to metabolism by aldehyde oxidase. Find out more:
www.domainex.co.uk/services/ald...
#ADME #Metabolism
We have recently updated our #ADME webpage to include details of our ChromLogD service.
ChromLogD is a fast, high-throughput alternative to the shake flask LogD. Find out more information on our website lnkd.in/ed8Ppbjk.
Are you looking for a new #ADME provider? #Domainex offer a wide range of assessments including:
- Physicochemical profiling
- Metabolic stability
- Permeability
Get in touch with our trusted experts through enquiries@domainex.co.uk to find out more about how we can assist you.
Worth reading if trying to exploit intramolecular hydrogen bonding in #ADME optimization: Smolyar & Cockroft (2025) Unveiling Repulsion in Intramolecular H-Bonded Systems. JACS 47:12381-12385 #Hbond #PhysChem #DrugDesign #MedChem #cheminformatics #OpenAccess #chemsky 🧪
doi.org/10.1021/jacs...
Turbidimetric (Kinetic) Solubility: As in vitro assays require test compounds to be in aqueous solution, it is important for them to be sufficiently soluble at assay concentrations. Domainex’s turbidimetric solubility assay is a cost-efficient, medium-throughput method. The assay is highly customisable, e.g. with regard to compound concentration, buffer, incubation time, etc...
Domainex offers a wide range of #ADME assays. Today we are highlighting our turbidimetric #solubility assay.
www.domainex.co.uk/services/tur...
Our turbidimetric solubility assay is an efficient medium throughput assay which is highly customisable.
Are you developing covalent inhibitors? Get in touch with #Domainex to find out how our GSH reactivity assay can help.
We also offer a wide range of #ADME assays.
Get in touch with us at enquiries@domainex.co.uk to find out more and ask us about our introductory discounts.
Tired of the local vs. global property-prediction model debate? Why not both? Our blog dives into this debate and provides evidence that a combined global+local approach performs the best. Learn more: inductive.bio/blog/local-v... #DrugDiscovery #ML #ADME #Biotech
Sharing that our exciting work with Nested Therapeutics in drug optimization is published! 🧬Our ML models helped overcome critical ADME issues to advance Nested’s program. Full story: inductive.bio/news/publica... #DrugDiscovery #ML #ADME #Biotech
A #FreeToRead article that will help you learn more about #pharmacokinetics and what happens to drugs in vivo: Webborn et al (2025) Free Drug Concepts: A Lingering Problem in #DrugDiscovery. J Med Chem 68:6850–6856 #DrugDesign #MedChem #DMPK #ADME #chemsky 🧪
doi.org/10.1021/acs....
🧪 Inside Recursion’s analytical chemistry lab. 🧪
Chad Bradford, Senior Director of Chemistry, shares our "RADME" (Recursion #ADME) approach for quickly generating chemistry insights – in vitro data – for drugs in development. www.youtube.com/shorts/0OpRp... #TechBio #chemistry
Are you looking for a new #ADME provider? #Domainex offer a wide variety of assessments, including glutathione reactivity. More information can be found on our website: bit.ly/4bECuSL
Get in touch with us at enquiries@domainex.co.uk
#DrugDiscovery #Caco2 #Stability #GSH
Jorgensen et al (JCIM 2025) #Permeability Benchmarking: Guidelines for Comparing in Silico, in Vitro, and in Vivo Measurements #cheminformatics #MedChem #CompChem #ADME #OpenAccess #chemsky 🧪
doi.org/10.1021/acs....
To kick off blogging for 2025 here is a post on aqueous #solvation and alkane/water #logP #PhysChem #CompChem #cheminformatics #MedChem #DrugDesign #DrugDiscovery #ADME #chemsky 🧪
fbdd-lit.blogspot.com/2025/03/thin...
Opportunity for Preclinical #DMPK Design Lead at AstraZeneca (Gothenburg Sweden) ref: R-221079 | closing: 17-Mar-2025 #ADME #AnalChem #MedChem #EUChemJobs #ChemJobs #chemsky 🧪
astrazeneca.wd3.myworkdayjobs.com/Careers/job/...
A nice piece of work from our rising stars Luca Menestrina and Raquel Parrondo! 🔝
🔎 www.mdpi.com/1999-4923/17...
Interested in generating novel small molecules for your new protein targets? Please contact us at info@chemotargets.com.
#ADME #MLmodels #AIDD #generativechemistry #drugclasses
Two opportunities at OpenADMET organization (remote) #ADME #ADMET #DMPK #ML #AI #cheminformatics #DataScience #chemsky 🧪
openadmet.org/jobs/
At high doses, enzyme systems saturate, shifting clearance to renal or biliary pathways. Tailored dosing strategies address this complexity. #Pharmacokinetics #ADME
Lipophilicity governs ADME: too lipophilic, and drugs dissolve poorly; too hydrophilic, and they can't penetrate membranes. Optimal balance is key for success. #ADME #DrugDesign #Pharmacology
Ah. Google #adme - unashamedly pushing a dystopian post-truth era, and using the Roman carnival of football clubs to suck us all in.
Koch et al (2024) Chromatographic Determination of Permeability-Relevant #Lipophilicity Facilitates Rapid Analysis of #Macrocyclic #Peptide Scaffolds. J Med Chem ASAP #logP #permeability #ADME #DrugDesign #PhysChem #AnalChem #OpenAccess #chemsky 🧪
doi.org/10.1021/acs....
#PostDoc opportunity: #InVitro #phenotypic assays and #ADME assays at University of São Paulo (São Carlos SP Brazil) ref: 2013/07600-3 | duration: 12 months | closing 03-Jul-2024 #Chagas #leishmaniasis #PostDocJobs 🧪
fapesp.br/oportunidade...
#PostDoc opportunity: #InVitro #phenotypic assays and #ADME assays at University of São Paulo (São Carlos SP Brazil) ref: 2013/07600-3 | duration: 12 months | closing 03-Jul-2024 #Chagas #leishmaniasis #PostDocJobs
fapesp.br/oportunidade...
Opportunity for drug metabolism & #pharmacokinetics scientist at MSD (London UK) ref: R299041 | closing: 07-Sep-2024 (UK date format) or 09-Jul-2024 (US date format) #DMPK #PKPD #ADME #UKChemJobs #ChemJobs #chemsky 🧪 jobs.msd.com/gb/en/job/R2...
Here's an article that I recommend to all #DrugDiscovery scientists (especially those who seek to transform the field with #AI/#ML): Smith & Rowland (2019) Drug Metab Disp 47:665-672 #DrugDesign #MedChem #ADME #cheminformatics
doi.org/10.1124/dmd....
