Table 3 Inter-set relationships of the compound data sets computed with the database fingerprint (DFP) and city block distance
From: Database fingerprint (DFP): an approach to represent molecular databases
Random | GDB13 | DNMT1 | GRAS | NP | SS | Benz | GS | Drugs | Clinical | EF | |
|---|---|---|---|---|---|---|---|---|---|---|---|
Random | 0 | ||||||||||
GDB13 | 54 | 0 | |||||||||
DNMT1 | 51 | 27 | 0 | ||||||||
GRAS | 67 | 27 | 42 | 0 | |||||||
NP | 63 | 39 | 24 | 48 | 0 | ||||||
SS | 65 | 32 | 34 | 22 | 43 | 0 | |||||
Benz | 64 | 35 | 33 | 43 | 32 | 46 | 0 | ||||
GS | 49 | 23 | 12 | 37 | 24 | 32 | 31 | 0 | |||
Drugs | 49 | 19 | 17 | 30 | 29 | 27 | 33 | 10 | 0 | ||
Clinical | 47 | 23 | 13 | 38 | 25 | 32 | 32 | 4 | 9 | 0 | |
EF | 50 | 26 | 12 | 42 | 24 | 37 | 32 | 8 | 15 | 9 | 0 |