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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03416958

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.78
NEB2-DEOXY-D-STREPTAMINEA1NEM0.71
YTB(1R,2R,3S,4R,5R)-5-aminocyclopentane-
1,2,3,4-tetrol
A3DX30.8
AZFAZAFAGOMINEA,B2J7H0.76
2TB1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANEA2TOB0.7
CYY2-DEOXYSTREPTAMINEA1QD30.71
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol
A,B2VL40.74
PA2PAROMOMYCIN (RING 2)B1O9M0.72
PA2PAROMOMYCIN (RING 2)A1PBR0.72
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.71
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.73
XIFPIPERIDINE-3,4-DIOLA1V0L0.75
XIFPIPERIDINE-3,4-DIOLA1V0N0.75
XIFPIPERIDINE-3,4-DIOLA1FH80.75
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.74
NOJ1-DEOXYNOJIRIMYCINA,B2J770.74
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.74
NOJ1-DEOXYNOJIRIMYCINA3GBE0.74
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.74
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.74
NOJ1-DEOXYNOJIRIMYCINA1DOG0.74
NOJ1-DEOXYNOJIRIMYCINA,B1I750.74
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.74
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.74
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.74
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.74
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.74
GOO(1R,2R,3R,4S,5R)-4-amino-5-methoxycyclopentane-
1,2,3-triol
A3DX40.73
OXZTETRAHYDROOXAZINEA,B1W3J1
OXZTETRAHYDROOXAZINEA1W3K1
OXZTETRAHYDROOXAZINEA1W3L1
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.76
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.76
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.76
TX4L-THREONOHYDROXAMATE 4-PHOSPHATEA,B1Q6L0.74
TX4L-THREONOHYDROXAMATE 4-PHOSPHATEA,B1SO40.74
TX4L-THREONOHYDROXAMATE 4-PHOSPHATEA,B1SO50.74
TX4L-THREONOHYDROXAMATE 4-PHOSPHATEA,B1SO30.74
TX4L-THREONOHYDROXAMATE 4-PHOSPHATEA,B1SO60.74
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1UP20.75
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D3GXF0.75
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCN0.75
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D2NSX0.75
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B1OIF0.75
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCQ0.75
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA2G9V0.75
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2J750.74
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A2V3G0.74
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2VQU0.74
AOL(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE-
1,2,3,4-TETROL
A2F7Q0.8
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A2ALW0.74