Results 121 to 130 of about 7,381 (220)

Large Library Docking for Polypharmacology. [PDF]

J Med Chem
Wu Y, Vigneron S, Braz J, Srinivasan K, Fink EA, Huang XP, Xu X, Huebner H, Kim JY, Wang J, Pfeiffer T, Sakamoto K, Radchenko DS, Rodriguiz RM, Moroz YS, Irwin JJ, Gmeiner P, Billesboelle C, Roth BL, Basbaum AI, Manglik A, Wetsel WC, Shoichet BK.   +22 more
europepmc   +1 more source

KLSD: A Curated Kinase-Ligand Database Mapping Selectivity Landscapes and Polypharmacology. [PDF]

ACS Omega
Chen C, Yuan Y, Li H, Lang X, Li C, Song Y, Liang M, Yang Y, Qiao X, Sun S, Zhou Z.   +10 more
europepmc   +1 more source

Drug Repurposing for AML: Structure-Based Virtual Screening and Molecular Simulations of FDA-Approved Compounds with Polypharmacological Potential. [PDF]

Biomedicines
Abdelsayed M, Boulaamane Y.
europepmc   +1 more source

The Necessity for Polypharmacological Research - An Editorial on 'Network Polypharmacology of ATP-binding Cassette (ABC) and Solute Carrier (SLC) Transporters'. [PDF]

Front Pharmacol
Rafehi M, Juvale K, Pulaski L, Stefan SM.   +3 more
europepmc   +1 more source

Dissecting Polypharmacology in Phenotypic Screening to Resolve Ferroptotic and Necrotic Cell-Death Mechanisms. [PDF]

ACS Med Chem Lett
Shimada K, Gregori-Puigjane E, Stokes ME, Skouta R, Stockwell BR.   +4 more
europepmc   +1 more source

Polypharmacology of S-1117, an Fc-fused IgG-selective degrading enzyme, for chronic treatment of autoantibody-mediated diseases. [PDF]

Proc Natl Acad Sci U S A
Sanmarco LM, Pellerin A, Green T, Plasencia A, Anderson JM, Le N, Newton A, Chen J, Ramello MC, Peckner R, Manasson J, Xing Y, Vital H, Higginson-Scott N, Sundy JS, Otipoby KL, Mascanfroni ID.   +16 more
europepmc   +1 more source

Proteochemometric modelling coupled to target prediction: an integrated approach for the simultaneous prediction of polypharmacology and binding affinity/potency of small molecules [PDF]

core   +1 more source

Dual-Target Insight into Drug Discovery from Natural Products as Modulators of GLP-1 and the TXNIP-Thioredoxin Antioxidant System in Metabolic Syndrome. [PDF]

Antioxidants (Basel)
Agu PC, Yudas AF, Lu J.
europepmc   +1 more source

Fragment-based discovery of dual ligand pharmacophores for lipid-sensing transcription factors for designed polypharmacology. [PDF]

RSC Med Chem
Stiller T, Duensing-Kropp S, Marschner JA, Merk D.   +3 more
europepmc   +1 more source

4-(5-Chloro-3-(3,4,5-trimethoxybenzoyl)-1H-indol-1-yl)benzenesulfonamide: A Novel Polypharmacology Agent to Target Carbonic Anhydrase IX and XII With Improved Selectivity, Wnt/β-Catenin Signaling Pathway, and P-Glycoprotein. [PDF]

ChemMedChem
Puxeddu M, Bordone R, Colla C, Rotili G, Coluccia A, Sciò P, Cuřínová P, Nocentini A, Supuran CT, Filiberti S, Turati M, Ronca R, Kopecka J, Riganti C, Jimenez L, Link W, Bigogno C, Dondio G, Barba M, Canettieri G, Silvestri R, La Regina G.   +21 more
europepmc   +1 more source