CASP1
Reference Set (550 Compounds)
ZINC000169360864 (search)
ZINC000026994541 (search)
ZINC000026994876 (search)
ZINC000003915255 (search)
ZINC000058564004 (search)
ZINC000058590864 (search)
ZINC000013605833 (search)
ZINC000013605837 (search)
ZINC000003932702 (search)
ZINC000027078096 (search)
ZINC000003940931 (search)
ZINC000058468511 (search)
ZINC000058591048 (search)
ZINC000026996621 (search)
ZINC000026147106 (search)
ZINC000029570540 (search)
ZINC000028569328 (search)
ZINC000013605835 (search)
ZINC000026388664 (search)
ZINC000026395143 (search)
ZINC000029566104 (search)
ZINC000013819023 (search)
ZINC000058590831 (search)
ZINC000014946681 (search)
ZINC000029570536 (search)
ZINC000026998255 (search)
ZINC000003933036 (search)
ZINC000013605838 (search)
ZINC000026952010 (search)
ZINC000003979277 (search)
ZINC000029306689 (search)
ZINC000013605831 (search)
ZINC000029570245 (search)
ZINC000026657209 (search)
ZINC000013819027 (search)
ZINC000027076941 (search)
ZINC000013819019 (search)
ZINC000026749163 (search)
ZINC000027085153 (search)
ZINC000029570050 (search)
ZINC000029568658 (search)
ZINC000026653134 (search)
ZINC000029571602 (search)
ZINC000029571842 (search)
ZINC000027891731 (search)
ZINC000013491992 (search)
ZINC000026997698 (search)
ZINC000003928062 (search)
ZINC000027076820 (search)
ZINC000026995487 (search)
ZINC000040394465 (search)
ZINC000058583226 (search)
ZINC000013819066 (search)
ZINC000058582180 (search)
ZINC000040395562 (search)
ZINC000026644159 (search)
ZINC000026391171 (search)
ZINC000058583130 (search)
ZINC000058583542 (search)
ZINC000026388661 (search)
ZINC000058581101 (search)
ZINC000058582614 (search)
ZINC000058583790 (search)
ZINC000058591188 (search)
ZINC000058581817 (search)
ZINC000058583224 (search)
ZINC000058590867 (search)
ZINC000169357219 (search)
ZINC000027555086 (search)
ZINC000058581872 (search)
ZINC000013491987 (search)
ZINC000058592306 (search)
ZINC000058581719 (search)
ZINC000027553709 (search)
ZINC000059112237 (search)
ZINC000029246853 (search)
ZINC000000895247 (search)
ZINC000026645782 (search)
ZINC000027557896 (search)
ZINC000059112236 (search)
ZINC000000120286 (search)
ZINC000013491971 (search)
ZINC000026639099 (search)
ZINC000058581897 (search)
ZINC000026381726 (search)
ZINC000071329676 (search)
ZINC000058582934 (search)
ZINC000071316369 (search)
ZINC000026744035 (search)
ZINC000058582959 (search)
ZINC000026642831 (search)
ZINC000026989629 (search)
ZINC000058651094 (search)
ZINC000058583165 (search)
ZINC000027555410 (search)
ZINC000169621223 (search)
ZINC000058582108 (search)
ZINC000027078055 (search)
ZINC000002944777 (search)
ZINC000058591357 (search)
ZINC000026997170 (search)
ZINC000026579974 (search)
ZINC000028022793 (search)
ZINC000028022417 (search)
ZINC000014286692 (search)
ZINC000028021875 (search)
ZINC000028764413 (search)
ZINC000028089519 (search)
ZINC000028764409 (search)
ZINC000028764665 (search)
ZINC000028088843 (search)
ZINC000028100454 (search)
ZINC000028022237 (search)
ZINC000028101114 (search)
ZINC000027897683 (search)
ZINC000004392044 (search)
ZINC000028107332 (search)
ZINC000028089687 (search)
ZINC000028763228 (search)
ZINC000028099801 (search)
ZINC000095541922 (search)
ZINC000028017905 (search)
ZINC000013543451 (search)
ZINC000028019951 (search)
ZINC000028016293 (search)
ZINC000013819334 (search)
ZINC000028101587 (search)
ZINC000027897670 (search)
ZINC000028089700 (search)
ZINC000026403426 (search)
ZINC000013819318 (search)
ZINC000028015795 (search)
ZINC000028093053 (search)
ZINC000003921873 (search)
ZINC000028019971 (search)
ZINC000026280343 (search)
ZINC000026281531 (search)
ZINC000028015128 (search)
ZINC000028013700 (search)
ZINC000026468365 (search)
ZINC000028016753 (search)
ZINC000028015653 (search)
ZINC000028018336 (search)
ZINC000013819323 (search)
ZINC000001541609 (search)
ZINC000026668280 (search)
ZINC000026669412 (search)
ZINC000028101920 (search)
ZINC000015722101 (search)
ZINC000026748126 (search)
ZINC000013819159 (search)
ZINC000026288149 (search)
ZINC000026291736 (search)
ZINC000028763568 (search)
ZINC000026747351 (search)
ZINC000028097610 (search)
ZINC000026670918 (search)
ZINC000001541606 (search)
ZINC000013819351 (search)
ZINC000013819282 (search)
ZINC000013819308 (search)
ZINC000028013680 (search)
ZINC000026752711 (search)
ZINC000026670477 (search)
ZINC000028013558 (search)
ZINC000013819153 (search)
ZINC000026668587 (search)
ZINC000026668596 (search)
ZINC000026670867 (search)
ZINC000026671929 (search)
ZINC000025966481 (search)
ZINC000003810730 (search)
ZINC000026467299 (search)
ZINC000013819223 (search)
ZINC000013819251 (search)
ZINC000026752314 (search)
ZINC000013819133 (search)
ZINC000013819138 (search)
ZINC000026672600 (search)
ZINC000001541607 (search)
ZINC000013819205 (search)
ZINC000026746068 (search)
ZINC000013819123 (search)
ZINC000025966487 (search)
ZINC000026746748 (search)
ZINC000013819103 (search)
ZINC000013819149 (search)
ZINC000013819143 (search)
ZINC000014947380 (search)
ZINC000026674491 (search)
ZINC000026670922 (search)
ZINC000026275085 (search)
ZINC000026268562 (search)
ZINC000026670473 (search)
ZINC000026269044 (search)
ZINC000013819211 (search)
ZINC000026672613 (search)
ZINC000026288211 (search)
ZINC000001541608 (search)
ZINC000026271506 (search)
ZINC000013819129 (search)
ZINC000013819262 (search)
ZINC000003993749 (search)
ZINC000026670338 (search)
ZINC000014947385 (search)
ZINC000028013660 (search)
ZINC000002567649 (search)
ZINC000013819056 (search)
ZINC000013589577 (search)
ZINC000026494159 (search)
ZINC000013819108 (search)
ZINC000013819228 (search)
ZINC000013819273 (search)
ZINC000013819268 (search)
ZINC000013819071 (search)
ZINC000013819313 (search)
ZINC000013819217 (search)
ZINC000029215162 (search)
ZINC000026395672 (search)
ZINC000026747941 (search)
ZINC000013819257 (search)
ZINC000013819234 (search)
ZINC000013819052 (search)
ZINC000013819239 (search)
ZINC000026401757 (search)
ZINC000013819245 (search)
ZINC000013819293 (search)
ZINC000013819277 (search)
ZINC000013589575 (search)
ZINC000013589576 (search)
ZINC000003810731 (search)
ZINC000001541603 (search)
ZINC000013819098 (search)
ZINC000013819303 (search)
ZINC000026667051 (search)
ZINC000014947273 (search)
ZINC000013819063 (search)
ZINC000013819060 (search)
ZINC000026275597 (search)
ZINC000029211308 (search)
ZINC000003993753 (search)
ZINC000029210660 (search)
ZINC000013819079 (search)
ZINC000001541605 (search)
ZINC000003993752 (search)
ZINC000026666712 (search)
ZINC000029208607 (search)
ZINC000026281163 (search)
ZINC000013819298 (search)
ZINC000029213533 (search)
ZINC000014947382 (search)
ZINC000013819181 (search)
ZINC000013819176 (search)
ZINC000014947297 (search)
ZINC000003993750 (search)
ZINC000027884110 (search)
ZINC000013819087 (search)
ZINC000013819047 (search)
ZINC000013819195 (search)
ZINC000001541604 (search)
ZINC000013819042 (search)
ZINC000221907040 (search)
ZINC000198204277 (search)
ZINC000163112277 (search)
ZINC000219193592 (search)
ZINC000204607394 (search)
ZINC000198204254 (search)
ZINC000198204206 (search)
ZINC000045339117 (search)
ZINC000058655489 (search)
ZINC000028713406 (search)
ZINC000058592872 (search)
ZINC000058583258 (search)
ZINC000028713437 (search)
ZINC000028713457 (search)
ZINC000028713459 (search)
ZINC000058582576 (search)
ZINC000058575808 (search)
ZINC000058591934 (search)
ZINC000058591078 (search)
ZINC000028713452 (search)
ZINC000028713455 (search)
ZINC000058582568 (search)
ZINC000058581277 (search)
ZINC000028713415 (search)
ZINC000028713450 (search)
ZINC000028880700 (search)
ZINC000058591286 (search)
ZINC000028713413 (search)
ZINC000058592875 (search)
ZINC000058583359 (search)
ZINC000058592876 (search)
ZINC000058582700 (search)
ZINC000013977348 (search)
ZINC000058590620 (search)
ZINC000028713447 (search)
ZINC000058582681 (search)
ZINC000028713445 (search)
ZINC000028880686 (search)
ZINC000058575783 (search)
ZINC000003962534 (search)
ZINC000028713433 (search)
ZINC000028825332 (search)
ZINC000028713439 (search)
ZINC000028713425 (search)
ZINC000028713435 (search)
ZINC001503886564 (search)
ZINC001772587272 (search)
ZINC000058581274 (search)
ZINC000058582022 (search)
ZINC000028713441 (search)
ZINC000095583085 (search)
ZINC000058582918 (search)
ZINC000028713427 (search)
ZINC000058582897 (search)
ZINC000028713443 (search)
ZINC000095581891 (search)
ZINC001772589037 (search)
ZINC000003928254 (search)
ZINC000028713431 (search)
ZINC000049762261 (search)
ZINC000033974590 (search)
ZINC001772606105 (search)
ZINC000029747252 (search)
ZINC000028713429 (search)
ZINC001772631436 (search)
ZINC000058590749 (search)
ZINC001772606320 (search)
ZINC000028713418 (search)
ZINC000058582896 (search)
ZINC000058590483 (search)
ZINC000058590754 (search)
ZINC000049755994 (search)
ZINC001772582414 (search)
ZINC000002512488 (search)
ZINC000028713423 (search)
ZINC001772648438 (search)
ZINC001772593091 (search)
ZINC001772636300 (search)
ZINC000049746806 (search)
ZINC001772657087 (search)
ZINC001772621229 (search)
ZINC000028880659 (search)
ZINC000028880673 (search)
ZINC000003994903 (search)
ZINC000103299376 (search)
ZINC001772574346 (search)
ZINC000049762438 (search)
ZINC000103298999 (search)
ZINC000049746367 (search)
ZINC000049767815 (search)
ZINC000058590468 (search)
ZINC000095584156 (search)
ZINC000049757534 (search)
ZINC000049746225 (search)
ZINC000103299379 (search)
ZINC000049745790 (search)
ZINC000036093009 (search)
ZINC000103299007 (search)
ZINC000049762465 (search)
ZINC000036093012 (search)
ZINC000028880644 (search)
ZINC000299819115 (search)
ZINC000095581513 (search)
ZINC000036093015 (search)
ZINC000036093010 (search)
ZINC000040876977 (search)
ZINC000036093014 (search)
ZINC000040405035 (search)
ZINC000036093016 (search)
ZINC000040422396 (search)
ZINC000036093017 (search)
ZINC000040943700 (search)
ZINC000040918266 (search)
ZINC000040423157 (search)
ZINC000040423296 (search)
ZINC000103299002 (search)
ZINC000040916039 (search)
ZINC000040916403 (search)
ZINC000028132941 (search)
ZINC000040949408 (search)
ZINC000049878620 (search)
ZINC000053188897 (search)
ZINC000036093013 (search)
ZINC000036093011 (search)
ZINC000045506625 (search)
ZINC000095605898 (search)
ZINC000299819063 (search)
ZINC000019835952 (search)
ZINC000299820095 (search)
ZINC000028129191 (search)
ZINC000028131876 (search)
ZINC000036092929 (search)
ZINC000028136397 (search)
ZINC000028129181 (search)
ZINC000028132760 (search)
ZINC000028135948 (search)
ZINC000003979930 (search)
ZINC000028137525 (search)
ZINC000028128735 (search)
ZINC000028135577 (search)
ZINC000028134270 (search)
ZINC000028136327 (search)
ZINC000028135595 (search)
ZINC000028132701 (search)
ZINC000003979932 (search)
ZINC000028136583 (search)
ZINC000028137447 (search)
ZINC000028137469 (search)
ZINC000001550171 (search)
ZINC000028122487 (search)
ZINC000003932929 (search)
ZINC000028132732 (search)
ZINC000028129890 (search)
ZINC000028136341 (search)
ZINC000003976004 (search)
ZINC000028132667 (search)
ZINC000028128279 (search)
ZINC000028136905 (search)
ZINC000028137579 (search)
ZINC000028122523 (search)
ZINC000028128616 (search)
ZINC000028125325 (search)
ZINC000028133553 (search)
ZINC000028136876 (search)
ZINC000028122473 (search)
ZINC000028133595 (search)
ZINC000028122899 (search)
ZINC000003928246 (search)
ZINC000028529749 (search)
ZINC000028529992 (search)
ZINC000028530004 (search)
ZINC000028530136 (search)
ZINC000028530140 (search)
ZINC000028530148 (search)
ZINC000028530176 (search)
ZINC000028530494 (search)
ZINC000028564274 (search)
ZINC000028564334 (search)
ZINC000028564486 (search)
ZINC000028129342 (search)
ZINC000028128302 (search)
ZINC000028136354 (search)
ZINC000028129928 (search)
ZINC000028136894 (search)
ZINC000003932930 (search)
ZINC000028133025 (search)
ZINC000028133607 (search)
ZINC000003932931 (search)
ZINC000028133106 (search)
ZINC000028530571 (search)
ZINC000003945995 (search)
ZINC000018207131 (search)
ZINC000028564636 (search)
ZINC000028564687 (search)
ZINC000028569185 (search)
ZINC000028569207 (search)
ZINC000028569248 (search)
ZINC000028569260 (search)
ZINC000028529717 (search)
ZINC000028530486 (search)
ZINC000003928230 (search)
ZINC000013975319 (search)
ZINC000003928064 (search)
ZINC000028530483 (search)
ZINC000028564657 (search)
ZINC000028569274 (search)
ZINC000028564584 (search)
ZINC000027077048 (search)
ZINC000027077447 (search)
ZINC000084611180 (search)
ZINC000027081704 (search)
ZINC000101047795 (search)
ZINC000016051411 (search)
ZINC000026995120 (search)
ZINC000003949863 (search)
ZINC000036092991 (search)
ZINC000028525013 (search)
ZINC000028564645 (search)
ZINC000028569327 (search)
ZINC000027073145 (search)
ZINC000028525795 (search)
ZINC000003870388 (search)
ZINC000036092967 (search)
ZINC000036092983 (search)
ZINC000016051416 (search)
ZINC000028526906 (search)
ZINC000036092959 (search)
ZINC000036092977 (search)
ZINC000028564573 (search)
ZINC000028569142 (search)
ZINC000101032205 (search)
ZINC000003976375 (search)
ZINC000036093003 (search)
ZINC000028564567 (search)
ZINC000036093001 (search)
ZINC000036092979 (search)
ZINC000101030977 (search)
ZINC000028569081 (search)
ZINC000028569146 (search)
ZINC000003928063 (search)
ZINC000028569247 (search)
ZINC000036092999 (search)
ZINC000028564628 (search)
ZINC000028564621 (search)
ZINC000036092971 (search)
ZINC000036092989 (search)
ZINC000036092995 (search)
ZINC000036093007 (search)
ZINC000028569268 (search)
ZINC000036092985 (search)
ZINC000036092961 (search)
ZINC000036092973 (search)
ZINC000028569290 (search)
ZINC000036092981 (search)
ZINC000101047810 (search)
ZINC000036092969 (search)
ZINC000028569203 (search)
ZINC000036092997 (search)
ZINC000003928306 (search)
ZINC000101032340 (search)
ZINC000036092957 (search)
ZINC000036092965 (search)
ZINC000036092987 (search)
ZINC000036092963 (search)
ZINC000028350164 (search)
ZINC000036092975 (search)
ZINC000028569183 (search)
ZINC000014947280 (search)
ZINC000014947295 (search)
ZINC000253639166 (search)
ZINC000028569140 (search)
ZINC000028569147 (search)
ZINC000003928313 (search)
ZINC000028569338 (search)
ZINC000014947301 (search)
ZINC000028569202 (search)
ZINC000028569319 (search)
ZINC000036092993 (search)
ZINC000014947284 (search)
ZINC000014947282 (search)
ZINC000014947281 (search)
ZINC000014947293 (search)
ZINC000028528646 (search)
ZINC000014947298 (search)
ZINC000028569318 (search)
ZINC000014947300 (search)
ZINC000028134509 (search)
ZINC000028350959 (search)
ZINC000014947291 (search)