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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01659429

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
A1XUZ0.77
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A2ALW0.71
17B(2Z,3R,4S,5R,6R)-2-[(4-aminobutyl)imino]-
6-(hydroxymethyl)piperidine-3,4,5-
triol
A,B2VR40.73
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2J750.71
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A2V3G0.71
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2VQU0.71
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE
A2BWM0.72
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE
A1O9V0.72
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.88
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.73
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.8
15A(2Z,3R,4S,5R,6R)-2-[(2-aminoethyl)imino]-
6-(hydroxymethyl)piperidine-3,4,5-
triol
A,B2VQT0.72
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R
2HIL0.7
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A2HI20.7
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.75
PA2PAROMOMYCIN (RING 2)B1O9M0.72
PA2PAROMOMYCIN (RING 2)A1PBR0.72
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A2JCQ0.71
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B2IH90.71
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B,C,D,E,F2J2P0.71
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A3DIV0.71
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.85
NOJ1-DEOXYNOJIRIMYCINA,B2J770.85
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.85
NOJ1-DEOXYNOJIRIMYCINA3GBE0.85
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.85
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.85
NOJ1-DEOXYNOJIRIMYCINA1DOG0.85
NOJ1-DEOXYNOJIRIMYCINA,B1I750.85
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.85
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.85
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.85
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.85
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.85
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.78
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol
A,B2VL40.71
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.77
XIFPIPERIDINE-3,4-DIOLA1V0L0.84
XIFPIPERIDINE-3,4-DIOLA1V0N0.84
XIFPIPERIDINE-3,4-DIOLA1FH80.84
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.82
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.82
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.82
IMRIMINORIBITOLA,B,C1I800.77
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.77
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
CGBCALYSTEGINE B2A,B2CBV0.73
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.77
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A1HWW0.71
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A3BLB0.71