Curated Binding Data
Drug-Target Interaction Dataset Download for Research
A central concept is that download corroborated records of drug interactions with affinity constants, structural data, and running results for moulding.
Why Use Our Dataset?
Model Drug Binding Accurately
Looking at this, 2M+ interactions on 10K butts and 500K connections with KI, IC50, CE50, associating stead and cell confirmation.
Every interaction, quantitatively measured.
See Dataset DocumentationQuantitative Binding Data
Ki, Kd, IC50 Across Assay Types
Primary, secondary, orthogonal assays reconciled.
Basically, standardized units, confidence separations and test tone grades allow reliable QSAR moulding and virtual screening.
Explore Binding Metrics
Structural Annotations
Co-crystal Structures and Docking Poses
PDB structures, homology models, covalent binders included.
A key finding shows that linking location coordinates, important interactions, and pharmacophoric procedures for structural aim lotions are typified.
Functional Validation
Cellular Target Engagement Data
Cellular thermal shift, competition binding, pathway modulation.
Looking at this, displacement of biochemical into cellular action with target confidence score and pharmacological profiles.
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