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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02475453

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.71
2TB1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANEA2TOB0.84
M6R5-AMINO-5-DEOXY-1-O-PHOSPHONO-D-
MANNITOL
A,B,C,D2PUV0.74
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.73
GCSD-GLUCOSAMINEA3CO40.73
GCSD-GLUCOSAMINEA1QGI0.73
GCSD-GLUCOSAMINEA,B2VZS0.73
GCSD-GLUCOSAMINEA1E9L0.73
GCSD-GLUCOSAMINEA,B,C,D3FXI0.73
GCSD-GLUCOSAMINEA,B2VZV0.73
AOL(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE-
1,2,3,4-TETROL
A2F7Q0.75
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1QD30.72
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
B1O9M0.72
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1NEM0.72
PA2PAROMOMYCIN (RING 2)B1O9M0.8
PA2PAROMOMYCIN (RING 2)A1PBR0.8
PA1PAROMOMYCIN (RING 1)A1PBR0.73
PA1PAROMOMYCIN (RING 1)A1QKC0.73
PA1PAROMOMYCIN (RING 1)A1QFG0.73
PA1PAROMOMYCIN (RING 1)A1FI10.73
PA1PAROMOMYCIN (RING 1)A,B,C,D3FXI0.73
PA1PAROMOMYCIN (RING 1)A1QFF0.73
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B,C,D,E,F1NE70.74
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA2ZJ40.74
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA1MOS0.74
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B1HOR0.74
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.73
NOJ1-DEOXYNOJIRIMYCINA,B2J770.73
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.73
NOJ1-DEOXYNOJIRIMYCINA3GBE0.73
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.73
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.73
NOJ1-DEOXYNOJIRIMYCINA1DOG0.73
NOJ1-DEOXYNOJIRIMYCINA,B1I750.73
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.73
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.73
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.73
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.73
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.73
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1QD30.72
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1NEM0.72
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1PBR0.72
CYY2-DEOXYSTREPTAMINEA1QD30.85
YTB(1R,2R,3S,4R,5R)-5-aminocyclopentane-
1,2,3,4-tetrol
A3DX30.75
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.79
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.73
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.71
GCN3-DEOXY-D-GLUCOSAMINEA1FI10.73
GCN3-DEOXY-D-GLUCOSAMINEA1QFG0.73
GCN3-DEOXY-D-GLUCOSAMINEA1QKC0.73
GCN3-DEOXY-D-GLUCOSAMINEA,B2GRX0.73
GCN3-DEOXY-D-GLUCOSAMINEA1QJQ0.73
GCN3-DEOXY-D-GLUCOSAMINEA1QFF0.73
CGFC-(1-AZIDO-ALPHA-D-GLUCOPYRANOSYL) FORMAMIDEA1P4G0.75
NEB2-DEOXY-D-STREPTAMINEA1NEM0.85
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.74
GE23,5-DIAMINO-CYCLOHEXANOLA1BYJ0.71