TABLE 1.
Overview of selected and synthesized molecules across teams (rows) and drug targets (columns). Molecules which were selected or tested for a specific target but submitted for another target do not contribute to the team counts. For statistics which also includes molecules which were originally submitted for a different target, see Supporting Information Section 3.
| Selected molecules (section 2.3) |
Synthesized compounds (section 2.4) |
|||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| N | Nsp3 | Nsp5 | Nsp12 | S | TMPRSS2 | SUM | N | Nsp3 | Nsp5 | Nsp12 | S | TMPRSS2 | SUM | |
| ai4science (1) | - | - | - | - | - | 499 | 499 | - | - | - | - | - | 16 | 16 |
| aiwinter (2) | - | 64 | 88 | - | - | 63 | 215 | - | 12 | 8 | - | - | 0 | 20 |
| belarus (3) | - | - | 32 | - | 67 | - | 99 | - | - | 0 | - | 0 | - | 0 |
| cermn (4) | - | 73 | 80 | - | - | 621 | 774 | - | 7 | 3 | - | - | 49 | 59 |
| covid19ddc (5) | - | 79 | 55 | 82 | - | - | 216 | - | 6 | 5 | 10 | - | - | 21 |
| deeplab (6) | - | 60 | 69 | - | 160 | - | 289 | - | 8 | 7 | - | 11 | - | 26 |
| imolecule (7) | 1013 | 81 | 66 | 358 | 402 | 0 | 1920 | 73 | 4 | 6 | 42 | 22 | 0 | 147 |
| jku (8) | - | 86 | 259 | 57 | - | - | 402 | - | 0 | 62 | 5 | - | - | 67 |
| kyuken (9) | - | 81 | 52 | - | 424 | - | 557 | - | 15 | 0 | - | 41 | - | 56 |
| lambdazero (10) | - | - | 32 | - | - | - | 32 | - | - | 0 | - | - | - | 0 |
| lci (11) | - | 1150 | 700 | 60 | - | - | 1910 | - | 86 | 54 | 5 | - | - | 145 |
| luxscreen (12) | - | - | 73 | 323 | - | 255 | 651 | - | - | 2 | 14 | - | 5 | 21 |
| nuwave (13) | 0 | 39 | 24 | - | - | - | 63 | 0 | 0 | 0 | - | - | - | 0 |
| pharmai (14) | - | - | 42 | - | 288 | - | 330 | - | - | 0 | - | 35 | - | 35 |
| safan (15) | - | 63 | 80 | 205 | - | - | 348 | - | 2 | 17 | 15 | - | - | 34 |
| sarstroopers (16) | - | 56 | 48 | 211 | 108 | - | 423 | - | 5 | 0 | 19 | 1 | - | 25 |
| sarswars (17) | 472 | - | 85 | 298 | - | - | 855 | 8 | - | 2 | 9 | - | - | 19 |
| virtualflow (18) | 547 | 46 | 107 | 369 | 219 | 463 | 1751 | 46 | 7 | 2 | 44 | 24 | 43 | 166 |
| way2drug (19) | - | 71 | 53 | 55 | - | 97 | 276 | - | 13 | 2 | 0 | - | 21 | 36 |
| yoda (20) | - | 69 | 90 | - | 337 | - | 496 | - | 3 | 11 | - | 22 | - | 36 |
| SUM | 2032 | 2018 | 2035 | 2018 | 2005 | 1998 | 12106 | 127 | 168 | 181 | 163 | 156 | 134 | 929 * |
*
of 929 total team-selected compounds, there are 878 unique chemical compounds. That is, 51 identical compounds were suggested. A dash indicates the team did not submit compounds for that specific target.