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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00014689

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PY0(1S,2S)-1-amino-1,2-dihydroxypropan-
1-olate
A,B,C,D2W930.71
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.78
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.78
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.78
XIFPIPERIDINE-3,4-DIOLA1V0L0.79
XIFPIPERIDINE-3,4-DIOLA1V0N0.79
XIFPIPERIDINE-3,4-DIOLA1FH80.79
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.74
NBA3-[(3-{[3-(METHYLAMINO)PROPYL]AMINO}PROPYL)AMINO]PROPANE-
1,1-DIOL
A,B,C1H860.7
NBA3-[(3-{[3-(METHYLAMINO)PROPYL]AMINO}PROPYL)AMINO]PROPANE-
1,1-DIOL
A,B,C1H840.7
FOP2-HYDROXY-PROPYL-AMMONIUMA1ID80.72
IMRIMINORIBITOLA,B,C1I800.72
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.72
THOREDUCED THREONINEA1SOC0.72
THOREDUCED THREONINEA2SOC0.72
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
A1E9W0.77
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
B1OLN0.77
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
C2JQ70.77