19 unique SMILES at similarity level 1
1pchembb (1)
| vendor_id | similarity_code |
| 1P006UFO | [0,0,0,0,0,0|1,0,0]=1 |
1pchembb (1)
| vendor_id | similarity_code |
| 1P0073CQ | [0,0,0,0,0,0|0,0,1]=1 |
aladdinsci (1)
| vendor_id | similarity_code |
| E336532 | [0,0,0,0,0,0|1,0,0]=1 |
aladdinsci (1)
| vendor_id | similarity_code |
| E342933 | [0,0,0,0,0,0|0,0,1]=1 |
apexbt (1)
| vendor_id | similarity_code |
| AMY7706 | [0,0,0,0,0,0|0,0,1]=1 |
apexmol (1)
| vendor_id | similarity_code |
| AMY7706 | [0,0,0,0,0,0|0,0,1]=1 |
apichem (1)
| vendor_id | similarity_code |
| AC-1083 | [0,0,0,0,0,0|0,0,1]=1 |
chemyuhao (1)
| vendor_id | similarity_code |
| YH28457 | [0,0,0,0,0,0|0,0,1]=1 |
boerchembb (1)
| vendor_id | similarity_code |
| BC208843 | [0,0,0,0,0,0|0,0,1]=1 |
cayman (1)
| vendor_id | similarity_code |
| 20513 | [0,0,0,0,0,0|0,0,1]=1 |
chebi (2)
| vendor_id | similarity_code |
| CHEBI:60050 | [0,0,0,0,0,0|0,0,1]=1 |
| CHEBI:8389 | [0,0,0,0,0,0|0,0,1]=1 |
tetrahedronbb (2)
| vendor_id | similarity_code |
| TS80061 | [0,0,0,0,0,0|0,0,1]=1 |
| TS80655 | [0,0,0,0,0,0|0,0,1]=1 |
dcm (1)
| vendor_id | similarity_code |
| 23667301 | [0,0,0,0,0,0|0,0,1]=1 |
fda (1)
| vendor_id | similarity_code |
| DB00286 | [0,0,0,0,0,0|0,0,1]=1 |
hmdbdrug (1)
| vendor_id | similarity_code |
| HMDB0012779 | [0,1,0,0,0,0|0,0,0]=1 |
hmdbendo (1)
| vendor_id | similarity_code |
| HMDB0012779 | [0,1,0,0,0,0|0,0,0]=1 |
hmdbfood (1)
| vendor_id | similarity_code |
| HMDB0012779 | [0,1,0,0,0,0|0,0,0]=1 |
keggdviapc (1)
| vendor_id | similarity_code |
| D00312 | [0,0,0,0,0,0|0,0,1]=1 |
mcee (1)
| vendor_id | similarity_code |
| HY-113293A | [0,0,0,0,0,0|0,0,1]=1 |
mcee (1)
| vendor_id | similarity_code |
| HY-113293B | [0,1,0,0,0,0|0,0,0]=1 |
mcep-v (1)
| vendor_id | similarity_code |
| HY-113293BR | [0,1,0,0,0,0|0,0,0]=1 |
mcep (1)
| vendor_id | similarity_code |
| HY-14585 | [0,0,0,0,0,0|1,0,0]=1 |
molnova (1)
| vendor_id | similarity_code |
| M28098 | [0,0,0,0,0,0|0,0,1]=1 |
targetmol (1)
| vendor_id | similarity_code |
| T36857 | [0,0,0,0,0,0|0,0,1]=1 |
urine (1)
| vendor_id | similarity_code |
| HMDB0012779 | [0,1,0,0,0,0|0,0,0]=1 |
urine (1)
| vendor_id | similarity_code |
| HMDB0012622 | [0,1,0,0,0,0|0,0,0]=1 |
11 unique SMILES at similarity level 2
001chem (1)
| vendor_id | similarity_code |
| DY564453 | [0,0,0,0,0,0|0,0,2]=2 |
1pchembb (1)
| vendor_id | similarity_code |
| 1P007XF8 | [0,0,0,0,0,0|0,0,2]=2 |
chebi (1)
| vendor_id | similarity_code |
| CHEBI:4866 | [0,0,0,0,0,0|0,0,2]=2 |
tetrahedronbb (1)
| vendor_id | similarity_code |
| TS66978 | [0,0,0,0,0,0|0,0,2]=2 |
chemscenep (1)
| vendor_id | similarity_code |
| CS-0027126 | [0,0,0,0,0,0|0,0,2]=2 |
hmdbdrug (1)
| vendor_id | similarity_code |
| HMDB0004448 | [0,0,0,0,0,0|0,0,2]=2 |
hmdbendo (1)
| vendor_id | similarity_code |
| HMDB0004448 | [0,0,0,0,0,0|0,0,2]=2 |
hmdbfood (1)
| vendor_id | similarity_code |
| HMDB0004448 | [0,0,0,0,0,0|0,0,2]=2 |
hmdbdrug (1)
| vendor_id | similarity_code |
| HMDB0012622 | [0,1,0,0,0,0|0,0,1]=2 |
hmdbendo (1)
| vendor_id | similarity_code |
| HMDB0012622 | [0,1,0,0,0,0|0,0,1]=2 |
hmdbfood (1)
| vendor_id | similarity_code |
| HMDB0012622 | [0,1,0,0,0,0|0,0,1]=2 |
keggcviapc (1)
| vendor_id | similarity_code |
| C08357 | [0,0,0,0,0,0|0,0,2]=2 |
keggcviapc (1)
| vendor_id | similarity_code |
| C02590 | [1,0,0,0,0,0|0,0,1]=2 |
keggcviapc (1)
| vendor_id | similarity_code |
| C08358 | [0,2,0,0,0,0|0,0,0]=2 |
pdb (1)
| vendor_id | similarity_code |
| ESO | [0,0,0,0,0,0|1,0,1]=2 |
urine (1)
| vendor_id | similarity_code |
| HMDB0004448 | [0,0,0,0,0,0|0,0,2]=2 |
16 unique SMILES at similarity level 3
1pchembb (1)
| vendor_id | similarity_code |
| 1P01EOE7 | [0,0,0,0,0,0|1,0,2]=3 |
abovchem (1)
| vendor_id | similarity_code |
| HY-U00112 | [0,0,0,0,0,0|1,0,2]=3 |
akscie-v (1)
| vendor_id | similarity_code |
| 2676AF | [1,0,0,0,0,0|2,0,0]=3 |
mcep-v (1)
| vendor_id | similarity_code |
| HY-111182 | [1,0,0,0,0,0|2,0,0]=3 |
ambintnp (1)
| vendor_id | similarity_code |
| Amb29844438 | [0,1,0,0,0,0|0,0,2]=3 |
chem4pharma (1)
| vendor_id | similarity_code |
| C4PST605 | [1,0,0,0,0,0|2,0,0]=3 |
chemyuhao (1)
| vendor_id | similarity_code |
| RT17067 | [0,0,0,0,0,0|0,0,3]=3 |
chemyuhao (1)
| vendor_id | similarity_code |
| RT17237 | [0,0,0,0,0,0|0,0,3]=3 |
dcm (1)
| vendor_id | similarity_code |
| 3275744 | [1,0,0,0,0,1|1,0,0]=3 |
keggcviapc (1)
| vendor_id | similarity_code |
| C13416 | [0,0,0,0,0,0|0,0,3]=3 |
keggcviapc (1)
| vendor_id | similarity_code |
| C15174 | [1,0,0,0,0,1|1,0,0]=3 |
mce (1)
| vendor_id | similarity_code |
| HY-U00112 | [0,0,0,0,0,0|1,0,2]=3 |
targetmolbio (1)
| vendor_id | similarity_code |
| T11235 | [0,0,0,0,0,0|1,0,2]=3 |
mcee (1)
| vendor_id | similarity_code |
| HY-141672 | [0,1,0,0,0,0|0,0,2]=3 |
pdb (1)
| vendor_id | similarity_code |
| VZ4 | [0,2,0,0,0,0|1,0,0]=3 |
targetmol (1)
| vendor_id | similarity_code |
| T19988 | [0,0,0,0,0,0|0,0,3]=3 |
targetmol (1)
| vendor_id | similarity_code |
| T11235 | [0,0,0,0,0,0|1,0,2]=3 |
tetrahedronbb (1)
| vendor_id | similarity_code |
| TS76559 | [1,0,0,0,0,0|2,0,0]=3 |
5 unique SMILES at similarity level 4
ibsbb (1)
| vendor_id | similarity_code |
| BB_NC-01501 | [1,1,0,0,0,0|2,0,0]=4 |
keggcviapc (1)
| vendor_id | similarity_code |
| C15424 | [0,0,0,0,0,0|1,0,3]=4 |
keggcviapc (1)
| vendor_id | similarity_code |
| C08359 | [0,2,0,0,0,0|0,0,2]=4 |
otavabb (1)
| vendor_id | similarity_code |
| 7569902 | [2,0,0,0,0,0|2,0,0]=4 |
tetrahedronbb (1)
| vendor_id | similarity_code |
| TS80717 | [0,1,0,0,0,0|0,0,3]=4 |