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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03687019

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.72
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.82
IFL(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
2-ONE
A,B1UZ10.78
IFL(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
2-ONE
A2V380.78
IFL(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
2-ONE
A,B2VJX0.78
IFL(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
2-ONE
A1UZ40.78
ISXGLUCOSE BETA-1,3-ISOFAGAMINEA2BVD0.73
IFG(2R,3R,4S,5R)-2-ACETAMIDO-3,4-DIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A1JAK0.78
IFG(2R,3R,4S,5R)-2-ACETAMIDO-3,4-DIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A,B1NOW0.78
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.7
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol
A,B2VL40.95
CGBCALYSTEGINE B2A,B2CBV0.71
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE
A3CUF0.74
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE
A,B2OYK0.74
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.79
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.79
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.79
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.79
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.79
NOJ1-DEOXYNOJIRIMYCINA,B2J770.79
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.79
NOJ1-DEOXYNOJIRIMYCINA3GBE0.79
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.79
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.79
NOJ1-DEOXYNOJIRIMYCINA1DOG0.79
NOJ1-DEOXYNOJIRIMYCINA,B1I750.79
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.79
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2J750.95
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A2V3G0.95
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2VQU0.95
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A2ALW0.95
OXZTETRAHYDROOXAZINEA,B1W3J0.75
OXZTETRAHYDROOXAZINEA1W3K0.75
OXZTETRAHYDROOXAZINEA1W3L0.75
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.72
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1UP21
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D3GXF1
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCN1
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D2NSX1
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B1OIF1
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCQ1
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA2G9V1
G2I(3R,4R,5R)-3-hydroxy-5-(hydroxymethyl)piperidin-
4-yl 4-O-beta-D-glucopyranosyl-
beta-D-glucopyranoside
A3CUH0.7
IMRIMINORIBITOLA,B,C1I800.77
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.77
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.72