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- W1982184411 endingPage "6103" @default.
- W1982184411 startingPage "6098" @default.
- W1982184411 abstract "Human inhibitor NF-κB kinase 2 (hIKK-2) is the primary component responsible for activating NF-κB in response to various inflammatory stimuli. Thus, synthetic ATP-competitive inhibitors for hIKK-2 have been developed as anti-inflammatory compounds. We recently reported a virtual screening protocol (doi:10.1371/journal.pone.0016903) that is able to identify hIKK-2 inhibitors that are not structurally related to any known molecule that inhibits hIKK-2 and that have never been reported to have anti-inflammatory activity. In this study, a stricter version of this protocol was applied to an in-house database of 29,779 natural products annotated with their natural source. The search identified 274 molecules (isolated from 453 different natural extracts) predicted to inhibit hIKK-2. An exhaustive bibliographic search revealed that anti-inflammatory activity has been previously described for: (a) 36 out of these 453 extracts; and (b) 17 out of 30 virtual screening hits present in these 36 extracts. Only one of the remaining 13 hit molecules in these extracts shows chemical similarity with known synthetic hIKK-2 inhibitors. Therefore, it is plausible that a significant portion of the remaining 12 hit molecules are lead-hopping candidates for the development of new hIKK-2 inhibitors." @default.
- W1982184411 created "2016-06-24" @default.
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- W1982184411 date "2011-12-01" @default.
- W1982184411 modified "2023-10-03" @default.
- W1982184411 title "Identification of human IKK-2 inhibitors of natural origin (Part II): In Silico prediction of IKK-2 inhibitors in natural extracts with known anti-inflammatory activity" @default.
- W1982184411 cites W1482830465 @default.
- W1982184411 cites W1958846836 @default.
- W1982184411 cites W1969159828 @default.
- W1982184411 cites W1970166054 @default.
- W1982184411 cites W1970271740 @default.
- W1982184411 cites W1971966967 @default.
- W1982184411 cites W1972715563 @default.
- W1982184411 cites W1975398550 @default.
- W1982184411 cites W1976973182 @default.
- W1982184411 cites W1978607701 @default.
- W1982184411 cites W1979021117 @default.
- W1982184411 cites W1980423337 @default.
- W1982184411 cites W1980965717 @default.
- W1982184411 cites W1981089266 @default.
- W1982184411 cites W1981214894 @default.
- W1982184411 cites W1981409559 @default.
- W1982184411 cites W1984815436 @default.
- W1982184411 cites W1987174399 @default.
- W1982184411 cites W1992226558 @default.
- W1982184411 cites W1994694127 @default.
- W1982184411 cites W1995343200 @default.
- W1982184411 cites W1999491936 @default.
- W1982184411 cites W1999780816 @default.
- W1982184411 cites W2003928462 @default.
- W1982184411 cites W2005542025 @default.
- W1982184411 cites W2005902174 @default.
- W1982184411 cites W2007599747 @default.
- W1982184411 cites W2007680694 @default.
- W1982184411 cites W2008219714 @default.
- W1982184411 cites W2008540071 @default.
- W1982184411 cites W2010639429 @default.
- W1982184411 cites W2010679882 @default.
- W1982184411 cites W2013179338 @default.
- W1982184411 cites W2013937001 @default.
- W1982184411 cites W2014810376 @default.
- W1982184411 cites W2018062382 @default.
- W1982184411 cites W2020658980 @default.
- W1982184411 cites W2021375500 @default.
- W1982184411 cites W2022004250 @default.
- W1982184411 cites W2024007575 @default.
- W1982184411 cites W2027112800 @default.
- W1982184411 cites W2027290929 @default.
- W1982184411 cites W2027971323 @default.
- W1982184411 cites W2031200361 @default.
- W1982184411 cites W2031871417 @default.
- W1982184411 cites W2033285009 @default.
- W1982184411 cites W2033846821 @default.
- W1982184411 cites W2036571570 @default.
- W1982184411 cites W2041834067 @default.
- W1982184411 cites W2042999911 @default.
- W1982184411 cites W2043892945 @default.
- W1982184411 cites W2047005782 @default.
- W1982184411 cites W2049902586 @default.
- W1982184411 cites W2050913638 @default.
- W1982184411 cites W2054085109 @default.
- W1982184411 cites W2055368162 @default.
- W1982184411 cites W2056620588 @default.
- W1982184411 cites W2057376436 @default.
- W1982184411 cites W2058607838 @default.
- W1982184411 cites W2059413742 @default.
- W1982184411 cites W2059892226 @default.
- W1982184411 cites W2060893195 @default.
- W1982184411 cites W2061245441 @default.
- W1982184411 cites W2063872513 @default.
- W1982184411 cites W2072278477 @default.
- W1982184411 cites W2078376298 @default.
- W1982184411 cites W2084421788 @default.
- W1982184411 cites W2085787009 @default.
- W1982184411 cites W2089354656 @default.
- W1982184411 cites W2090658545 @default.
- W1982184411 cites W2090739441 @default.
- W1982184411 cites W2091163114 @default.
- W1982184411 cites W2093850264 @default.
- W1982184411 cites W2095065426 @default.
- W1982184411 cites W2096836174 @default.
- W1982184411 cites W2096864392 @default.
- W1982184411 cites W2108400611 @default.
- W1982184411 cites W2108587366 @default.
- W1982184411 cites W2117877053 @default.
- W1982184411 cites W2120349335 @default.