A Quantum Similarity Approach for the Discovery of Anti-Trypanosome Drug Leads

Award Information
Agency: Department of Health and Human Services
Branch: N/A
Contract: 1R43AI114078-01
Agency Tracking Number: R43AI114078
Amount: $225,000.00
Phase: Phase I
Program: SBIR
Solicitation Topic Code: NIAID
Solicitation Number: PA13-234
Timeline
Solicitation Year: 2014
Award Year: 2014
Award Start Date (Proposal Award Date): N/A
Award End Date (Contract End Date): N/A
Small Business Information
8040 JUNIPER DRIIVE, PARK CITY, UT, 84098-
DUNS: 831339564
HUBZone Owned: N
Woman Owned: N
Socially and Economically Disadvantaged: N
Principal Investigator
 MARTIN MARTINOV
 (202) 640-9576
 martinov.mn@gradientbiomodeling.com
Business Contact
 NICK KALUDOV
Phone: (202) 640-9576
Email: kaludov.n@gradientbiomodeling.com
Research Institution
 Stub
Abstract
DESCRIPTION (provided by applicant): Human African trypanosomiasis (HAT) is an infectious disease with a large global health burden occurring primarily in Central and Eastern Africa. HAT is 100% fatal if untreated and the current drug therapies suffer frompoor safety profiles, difficult treatment regimens, limited effectiveness, and high costs. Furthermore, drugs that cross the blood brain barrier (BBB) are notoriously difficult to develop and have a lower probability of reaching the market place. Here, wepropose to apply a quantum-similarity approach to discover novel T. Brucei inhibitors. The approach allows for simultaneous interrogation of multiple targets and pathways, and for incorporation of various pharmacological requirements early in the discovery process, thus increasing the chances of finding novel therapeutics with great selectivity, potency and pharmacokinetic properties. Instead of screening millions of compounds for novel modulators of the target of interest, our focused testing of 10-2

* Information listed above is at the time of submission. *

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