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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02435423

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A2JCQ0.7
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B2IH90.7
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B,C,D,E,F2J2P0.7
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A3DIV0.7
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1UP20.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D3GXF0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCN0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D2NSX0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B1OIF0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCQ0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA2G9V0.71
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.79
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
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.74
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.81
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.81
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.81
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.81
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.81
NOJ1-DEOXYNOJIRIMYCINA,B2J770.81
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.81
NOJ1-DEOXYNOJIRIMYCINA3GBE0.81
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.81
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.81
NOJ1-DEOXYNOJIRIMYCINA1DOG0.81
NOJ1-DEOXYNOJIRIMYCINA,B1I750.81
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.81
HHO1-(HYDROXYMETHYLENEAMINO)-8-HYDROXY-
OCTANE
I,J1AY60.71
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.8
HQ6N-[(3R,4S,5R,6R,7R)-3,5,6-trihydroxy-
7-(hydroxymethyl)azepan-4-yl]acetamide
A,B2W660.71
IMRIMINORIBITOLA,B,C1I800.73
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.73
M1C(3S)-3-AMINO-1-(CYCLOPROPYLAMINO)HEPTANE-
2,2-DIOL
A1QXW0.71
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.74
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.76
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.86
AHS(3-AMINO-4-CYCLOHEXYL-2-HYDROXY-
BUTYL)-ISOBUTYL-CARBAMIC ACID
I5ER20.71
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.74
PTOPSEUDOTROPINEA,B2AE20.74
CGBCALYSTEGINE B2A,B2CBV0.75