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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03209768

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CGBCALYSTEGINE B2A,B2CBV0.94
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol
A,B2VL40.72
IMRIMINORIBITOLA,B,C1I800.8
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.8
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.83
CTSCASTANOSPERMINEA1EQC0.73
CTSCASTANOSPERMINEA,B2JKP0.73
CTSCASTANOSPERMINEA,B,C2VL80.73
CTSCASTANOSPERMINEA,B2CBU0.73
CTSCASTANOSPERMINEA,B2PWG0.73
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.81
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.79
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.79
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.79
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.79
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.75
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
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.83
XIFPIPERIDINE-3,4-DIOLA1V0L0.75
XIFPIPERIDINE-3,4-DIOLA1V0N0.75
XIFPIPERIDINE-3,4-DIOLA1FH80.75
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2J750.72
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A2V3G0.72
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2VQU0.72
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1UP20.72
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D3GXF0.72
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCN0.72
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D2NSX0.72
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B1OIF0.72
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCQ0.72
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA2G9V0.72
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.71
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A2ALW0.72
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.76
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.76
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.76
PTOPSEUDOTROPINEA,B2AE20.73
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A1HWW0.76
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A3BLB0.76
YRR3-HYDROXY-PYRROLIDIN-2-YLMETHYL-
MONOPHOSPHATE GROUP
A,D1F6O0.7
YRR3-HYDROXY-PYRROLIDIN-2-YLMETHYL-
MONOPHOSPHATE GROUP
D1BNK0.7