Contact Proteins for Similar Compounds
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threshold chemical similarty (tanimoto coefficient) |
[0.5] [0.6] [0.7] [0.8] [0.9] [1.0] | max number of compounds | [1] [5] [10] [20] [30] [40] [50] |
compound | similarity | compound | similarity | compound | similarity | compound | similarity | compound | similarity |
query
[D00429] [2D] [3D] |
*** | ROC | 1.000 | 0PO | 0.772 | RO1 | 0.737 | KNI | 0.610 |
1UN | 0.589 | 0DO | 0.583 | RSZ | 0.576 | PI4 | 0.571 | V3D | 0.525 |
NYF | 0.508 | 0AX | 0.500 | 89K | 0.500 | GGX | 0.493 | 06Q | 0.492 |
49W | 0.492 | 89B | 0.492 | 8O5 | 0.492 | K95 | 0.485 | M91 | 0.484 |
VAC | 0.484 | LZT | 0.484 | 8V9 | 0.478 | 8VO | 0.478 | HUR | 0.475 |
V7G | 0.475 | MU0 | 0.470 | CX1 | 0.469 | 00I | 0.468 | BD5 | 0.462 |
BD7 | 0.462 | L3T | 0.462 | 075 | 0.458 | RUN | 0.455 | L2T | 0.453 |
O33 | 0.451 | OIS | 0.448 | MK1 | 0.446 | AB1 | 0.439 | GW2 | 0.439 |
XN1 | 0.439 | 0GO | 0.435 | GWT | 0.426 | L75 | 0.426 | XN3 | 0.426 |
009 | 0.424 | 7J0 | 0.422 | U5Y | 0.420 | XN2 | 0.420 | IPF | 0.420 |
GVW | 0.418 |