8 unique SMILES at similarity level 1
1pchembb (1)
| vendor_id | similarity_code |
| 1P01EOE7 | [0,0,0,0,0,0|1,0,0]=1 |
abovchem (1)
| vendor_id | similarity_code |
| HY-U00112 | [0,0,0,0,0,0|1,0,0]=1 |
ambintnp (1)
| vendor_id | similarity_code |
| Amb29844438 | [0,1,0,0,0,0|0,0,0]=1 |
chemyuhao (1)
| vendor_id | similarity_code |
| RT17237 | [0,0,0,0,0,0|0,0,1]=1 |
keggcviapc (1)
| vendor_id | similarity_code |
| C02590 | [1,0,0,0,0,0|0,0,0]=1 |
mce (1)
| vendor_id | similarity_code |
| HY-U00112 | [0,0,0,0,0,0|1,0,0]=1 |
targetmolbio (1)
| vendor_id | similarity_code |
| T11235 | [0,0,0,0,0,0|1,0,0]=1 |
mcee (1)
| vendor_id | similarity_code |
| HY-141672 | [0,1,0,0,0,0|0,0,0]=1 |
targetmol (1)
| vendor_id | similarity_code |
| T11235 | [0,0,0,0,0,0|1,0,0]=1 |
22 unique SMILES at similarity level 2
1pchembb (1)
| vendor_id | similarity_code |
| 1P003BDY | [0,0,0,0,0,0|0,0,2]=2 |
1pchembb (1)
| vendor_id | similarity_code |
| 1P000LUO | [0,0,0,0,0,0|0,0,2]=2 |
abovchem (1)
| vendor_id | similarity_code |
| HY-B1361 | [0,0,0,0,0,0|0,0,2]=2 |
dbfda (1)
| vendor_id | similarity_code |
| DB04574 | [0,0,0,0,0,0|0,0,2]=2 |
fda (1)
| vendor_id | similarity_code |
| DB04574 | [0,0,0,0,0,0|0,0,2]=2 |
hmdbdrug (1)
| vendor_id | similarity_code |
| HMDB0001425 | [0,0,0,0,0,0|0,0,2]=2 |
hmdbendo (1)
| vendor_id | similarity_code |
| HMDB0001425 | [0,0,0,0,0,0|0,0,2]=2 |
hmdbfood (1)
| vendor_id | similarity_code |
| HMDB0001425 | [0,0,0,0,0,0|0,0,2]=2 |
aceschem (1)
| vendor_id | similarity_code |
| ACS024009 | [0,0,0,0,0,0|0,0,2]=2 |
chebi (1)
| vendor_id | similarity_code |
| CHEBI:17474 | [0,0,0,0,0,0|0,0,2]=2 |
coresyn (1)
| vendor_id | similarity_code |
| CM14419 | [0,0,0,0,0,0|0,0,2]=2 |
tetrahedronbb (1)
| vendor_id | similarity_code |
| TS70241 | [0,0,0,0,0,0|0,0,2]=2 |
tocris (1)
| vendor_id | similarity_code |
| 3588 | [0,0,0,0,0,0|0,0,2]=2 |
akscie-v (1)
| vendor_id | similarity_code |
| K241 | [0,0,0,0,0,0|0,0,2]=2 |
keggcviapc (1)
| vendor_id | similarity_code |
| C02538 | [0,0,0,0,0,0|0,0,2]=2 |
keggdviapc (1)
| vendor_id | similarity_code |
| D00948 | [0,0,0,0,0,0|0,0,2]=2 |
mce-v (1)
| vendor_id | similarity_code |
| HY-B1361R | [0,0,0,0,0,0|0,0,2]=2 |
mcee (1)
| vendor_id | similarity_code |
| HY-B1361 | [0,0,0,0,0,0|0,0,2]=2 |
aladdinsci (3)
| vendor_id | similarity_code |
| E304488 | [0,0,0,0,0,0|0,0,2]=2 |
| E336730 | [0,0,0,0,0,0|0,0,2]=2 |
| E425689 | [0,0,0,0,0,0|0,0,2]=2 |
selleck (2)
| vendor_id | similarity_code |
| S5288 | [0,0,0,0,0,0|0,0,2]=2 |
| S5288 | [0,0,0,0,0,0|0,0,2]=2 |
ambintnp (1)
| vendor_id | similarity_code |
| Amb28974607 | [0,0,0,0,0,0|0,0,2]=2 |
apexbt (1)
| vendor_id | similarity_code |
| AM20080957 | [0,0,0,0,0,0|0,0,2]=2 |
apexmol (1)
| vendor_id | similarity_code |
| AM20080957 | [0,0,0,0,0,0|0,0,2]=2 |
astatech (1)
| vendor_id | similarity_code |
| A12796 | [0,0,0,0,0,0|0,0,2]=2 |
dball (1)
| vendor_id | similarity_code |
| DB04574 | [0,0,0,0,0,0|0,0,2]=2 |
dbap (1)
| vendor_id | similarity_code |
| DB04574 | [0,0,0,0,0,0|0,0,2]=2 |
urine (1)
| vendor_id | similarity_code |
| HMDB0001425 | [0,0,0,0,0,0|0,0,2]=2 |
bcp (1)
| vendor_id | similarity_code |
| BCP05424 | [0,0,0,0,0,0|0,0,2]=2 |
capot (1)
| vendor_id | similarity_code |
| 22728 | [0,0,0,0,0,0|0,0,2]=2 |
hairui (1)
| vendor_id | similarity_code |
| HR112501 | [0,0,0,0,0,0|0,0,2]=2 |
molcore (1)
| vendor_id | similarity_code |
| MC10222 | [0,0,0,0,0,0|0,0,2]=2 |
keggcviapc (1)
| vendor_id | similarity_code |
| C15424 | [0,0,0,0,0,0|1,0,1]=2 |
keggcviapc (1)
| vendor_id | similarity_code |
| C08359 | [0,2,0,0,0,0|0,0,0]=2 |
lincs (1)
| vendor_id | similarity_code |
| BRD-A22143024 | [0,0,0,0,0,0|0,0,2]=2 |
lincs (1)
| vendor_id | similarity_code |
| BRD-K70515009 | [0,0,0,0,0,0|0,0,2]=2 |
lincs (1)
| vendor_id | similarity_code |
| BRD-K51095933 | [0,0,0,0,0,0|0,0,2]=2 |
molepedia (1)
| vendor_id | similarity_code |
| M10103414P | [0,0,0,0,0,0|0,0,2]=2 |
molnova (1)
| vendor_id | similarity_code |
| M28099 | [0,0,0,0,0,0|0,0,2]=2 |
targetmol (1)
| vendor_id | similarity_code |
| T36857L | [0,0,0,0,0,0|0,0,2]=2 |
targetmol (1)
| vendor_id | similarity_code |
| T0345 | [0,0,0,0,0,0|0,0,2]=2 |
targetmolbio (1)
| vendor_id | similarity_code |
| T0345 | [0,0,0,0,0,0|0,0,2]=2 |
tetrahedronbb (1)
| vendor_id | similarity_code |
| TS80717 | [0,1,0,0,0,0|0,0,1]=2 |
25 unique SMILES at similarity level 3
1pchembb (1)
| vendor_id | similarity_code |
| 1P006UFO | [0,0,0,0,0,0|1,0,2]=3 |
1pchembb (1)
| vendor_id | similarity_code |
| 1P0073CQ | [0,0,0,0,0,0|0,0,3]=3 |
aladdinsci (1)
| vendor_id | similarity_code |
| E336532 | [0,0,0,0,0,0|1,0,2]=3 |
aladdinsci (1)
| vendor_id | similarity_code |
| E342933 | [0,0,0,0,0,0|0,0,3]=3 |
apexbt (1)
| vendor_id | similarity_code |
| AMY7706 | [0,0,0,0,0,0|0,0,3]=3 |
apexmol (1)
| vendor_id | similarity_code |
| AMY7706 | [0,0,0,0,0,0|0,0,3]=3 |
apichem (1)
| vendor_id | similarity_code |
| AC-1083 | [0,0,0,0,0,0|0,0,3]=3 |
chemyuhao (1)
| vendor_id | similarity_code |
| YH28457 | [0,0,0,0,0,0|0,0,3]=3 |
boerchembb (1)
| vendor_id | similarity_code |
| BC208843 | [0,0,0,0,0,0|0,0,3]=3 |
cayman (1)
| vendor_id | similarity_code |
| 20513 | [0,0,0,0,0,0|0,0,3]=3 |
chebi (2)
| vendor_id | similarity_code |
| CHEBI:60050 | [0,0,0,0,0,0|0,0,3]=3 |
| CHEBI:8389 | [0,0,0,0,0,0|0,0,3]=3 |
tetrahedronbb (2)
| vendor_id | similarity_code |
| TS80061 | [0,0,0,0,0,0|0,0,3]=3 |
| TS80655 | [0,0,0,0,0,0|0,0,3]=3 |
chemyuhao (1)
| vendor_id | similarity_code |
| RT17251 | [0,0,0,0,0,0|0,0,3]=3 |
chemyuhao (1)
| vendor_id | similarity_code |
| RT17254 | [0,0,0,0,0,0|0,0,3]=3 |
dball (1)
| vendor_id | similarity_code |
| DB13952 | [1,0,0,0,0,0|2,0,0]=3 |
dbap (1)
| vendor_id | similarity_code |
| DB13952 | [1,0,0,0,0,0|2,0,0]=3 |
dbin (1)
| vendor_id | similarity_code |
| DB13952 | [1,0,0,0,0,0|2,0,0]=3 |
dcm (1)
| vendor_id | similarity_code |
| 23667301 | [0,0,0,0,0,0|0,0,3]=3 |
fda (1)
| vendor_id | similarity_code |
| DB00286 | [0,0,0,0,0,0|0,0,3]=3 |
hmdbdrug (1)
| vendor_id | similarity_code |
| HMDB0012779 | [0,1,0,0,0,0|0,0,2]=3 |
hmdbendo (1)
| vendor_id | similarity_code |
| HMDB0012779 | [0,1,0,0,0,0|0,0,2]=3 |
hmdbfood (1)
| vendor_id | similarity_code |
| HMDB0012779 | [0,1,0,0,0,0|0,0,2]=3 |
keggdviapc (1)
| vendor_id | similarity_code |
| D00312 | [0,0,0,0,0,0|0,0,3]=3 |
keggdviapc (1)
| vendor_id | similarity_code |
| D04061 | [1,0,0,0,0,0|2,0,0]=3 |
mcee (1)
| vendor_id | similarity_code |
| HY-113293A | [0,0,0,0,0,0|0,0,3]=3 |
mcee (1)
| vendor_id | similarity_code |
| HY-113293B | [0,1,0,0,0,0|0,0,2]=3 |
mcep-v (1)
| vendor_id | similarity_code |
| HY-113293BR | [0,1,0,0,0,0|0,0,2]=3 |
mcep (1)
| vendor_id | similarity_code |
| HY-14585 | [0,0,0,0,0,0|1,0,2]=3 |
molnova (1)
| vendor_id | similarity_code |
| M28098 | [0,0,0,0,0,0|0,0,3]=3 |
pdb (1)
| vendor_id | similarity_code |
| VZ5 | [0,2,0,0,0,0|1,0,0]=3 |
pdb (1)
| vendor_id | similarity_code |
| WZA | [0,2,0,0,0,0|1,0,0]=3 |
targetmol (1)
| vendor_id | similarity_code |
| T36857 | [0,0,0,0,0,0|0,0,3]=3 |
urine (1)
| vendor_id | similarity_code |
| HMDB0012779 | [0,1,0,0,0,0|0,0,2]=3 |
urine (1)
| vendor_id | similarity_code |
| HMDB0012622 | [0,1,0,0,0,0|0,0,2]=3 |
5 unique SMILES at similarity level 4
001chem (1)
| vendor_id | similarity_code |
| DY564453 | [0,0,0,0,0,0|0,0,4]=4 |
chemscenep (1)
| vendor_id | similarity_code |
| CS-0027126 | [0,0,0,0,0,0|0,0,4]=4 |
hmdbdrug (1)
| vendor_id | similarity_code |
| HMDB0012622 | [0,1,0,0,0,0|0,0,3]=4 |
hmdbendo (1)
| vendor_id | similarity_code |
| HMDB0012622 | [0,1,0,0,0,0|0,0,3]=4 |
hmdbfood (1)
| vendor_id | similarity_code |
| HMDB0012622 | [0,1,0,0,0,0|0,0,3]=4 |
keggcviapc (1)
| vendor_id | similarity_code |
| C08358 | [0,2,0,0,0,0|0,0,2]=4 |
pdb (1)
| vendor_id | similarity_code |
| ESO | [0,0,0,0,0,0|1,0,3]=4 |