
Nostrum Biodiscovery is a biotech spin-off from the Barcelona Supercomputing Center and the Institute for Research in Biomedicine, specializing in AI-powered molecular design and advanced molecular modeling technologies. The company focuses on therapeutics, including small molecules, targeted protein degradation, antibodies, immunologics, nucleic acids, and bio-based chemistry such as enzyme engineering. Their proprietary platform, including the PELE Monte-Carlo molecular modeling algorithm and AI tools, enables efficient screening, de novo design, and optimization of molecules. Nostrum offers customer-tailored solutions through services, licensing, and co-development, serving clients in over 12 countries with expansion in the US, Asia, and Latin America. The company is recognized for innovation, scientific excellence, and strong international presence in computational drug discovery and molecular design.

Nostrum Biodiscovery is a biotech spin-off from the Barcelona Supercomputing Center and the Institute for Research in Biomedicine, specializing in AI-powered molecular design and advanced molecular modeling technologies. The company focuses on therapeutics, including small molecules, targeted protein degradation, antibodies, immunologics, nucleic acids, and bio-based chemistry such as enzyme engineering. Their proprietary platform, including the PELE Monte-Carlo molecular modeling algorithm and AI tools, enables efficient screening, de novo design, and optimization of molecules. Nostrum offers customer-tailored solutions through services, licensing, and co-development, serving clients in over 12 countries with expansion in the US, Asia, and Latin America. The company is recognized for innovation, scientific excellence, and strong international presence in computational drug discovery and molecular design.
Founded: 2015 (Barcelona spin-off from BSC-CNS and IRB)
Focus: AI-powered molecular design and molecular modeling for therapeutics and bio-based chemistry
Proprietary tech: PELE Monte-Carlo molecular modeling algorithm; NBDSuite; XNA-Hub
Business model: Services, licensing, and co-development (clients retain IP)
Funding signal: Seed rounds; investors include CDTI and Santander
Computational drug discovery, molecular design and bio-based chemistry (enzyme engineering, nucleic acids, antibodies, targeted protein degradation).
2015
Biotechnology
781,454 USD
Public profiles report two funding rounds with CDTI and Santander listed as investors.
“CDTI; Santander (reported investors/supporters)”