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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03091883

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GRF5-O-PHOSPHONO-BETA-D-RIBOFURANOSYLAMINEA1ZLY0.73
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1QD30.85
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
B1O9M0.85
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1NEM0.85
GE35-METHYL-4-METHYLAMINO-TETRAHYDRO-
PYRAN-2,3,5-TRIOL
A1BYJ0.7
M6PALPHA-D-MANNOSE-6-PHOSPHATEA,B1SZ00.77
M6PALPHA-D-MANNOSE-6-PHOSPHATEX1PCM0.77
M6PALPHA-D-MANNOSE-6-PHOSPHATEA,B2GC30.77
M6PALPHA-D-MANNOSE-6-PHOSPHATEA,B1SYO0.77
M6PALPHA-D-MANNOSE-6-PHOSPHATEA,B3C0O0.77
M6PALPHA-D-MANNOSE-6-PHOSPHATEA,B2RL90.77
M6PALPHA-D-MANNOSE-6-PHOSPHATEA,B1M6P0.77
GDA4-DEOXY-4-AMINO-BETA-D-GLUCOSEA,B1OCB0.88
LPSO-{HYDROXY[((2R)-2-HYDROXY-3-{[(1S)-
1-HYDROXYPENTADECYL]OXY}PROPYL)OXY]PHOSPHORYL}-
L-SERINE
A1NL20.7
NG1N-ACETYL-ALPHA-D-GALACTOSAMINE 1-
PHOSPHATE
A2A2C0.76
NG1N-ACETYL-ALPHA-D-GALACTOSAMINE 1-
PHOSPHATE
A,B2DKD0.76
SGNN,O6-DISULFO-GLUCOSAMINEA,B1FQ90.78
SGNN,O6-DISULFO-GLUCOSAMINEB2AXM0.78
SGNN,O6-DISULFO-GLUCOSAMINEA,B1GMN0.78
SGNN,O6-DISULFO-GLUCOSAMINEA,B1T8U0.78
SGNN,O6-DISULFO-GLUCOSAMINEA1BFB0.78
SGNN,O6-DISULFO-GLUCOSAMINEB,D,F,H1XMN0.78
SGNN,O6-DISULFO-GLUCOSAMINEA,B,C,D,E,F,
G,H
1GMO0.78
SGNN,O6-DISULFO-GLUCOSAMINEA,B,C,D,E,F1AXM0.78
SGNN,O6-DISULFO-GLUCOSAMINEA1XT30.78
SGNN,O6-DISULFO-GLUCOSAMINE11QQP0.78
SGNN,O6-DISULFO-GLUCOSAMINEA,B1RID0.78
SGNN,O6-DISULFO-GLUCOSAMINEA1G5N0.78
SGNN,O6-DISULFO-GLUCOSAMINEA,B2BRS0.78
SGNN,O6-DISULFO-GLUCOSAMINEA1HPN0.78
SGNN,O6-DISULFO-GLUCOSAMINEA1ZA40.78
SGNN,O6-DISULFO-GLUCOSAMINE11ZBA0.78
SGNN,O6-DISULFO-GLUCOSAMINEA1BFC0.78
SGNN,O6-DISULFO-GLUCOSAMINEA,B,C,D2VRA0.78
SGNN,O6-DISULFO-GLUCOSAMINEA2HYV0.78
SGNN,O6-DISULFO-GLUCOSAMINEH,I3B9F0.78
SGNN,O6-DISULFO-GLUCOSAMINEA,B3DY00.78
SGNN,O6-DISULFO-GLUCOSAMINEA2HYU0.78
SGNN,O6-DISULFO-GLUCOSAMINEB,C,D,E1E0O0.78
KANKANAMYCIN AA1L8T0.72
KANKANAMYCIN AA,B1M4I0.72
KANKANAMYCIN AA,B1ND40.72
KANKANAMYCIN AA,B1KNY0.72
KANKANAMYCIN AA,B2ESI0.72
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7Y0.83
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7X0.83
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R810.83
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7V0.83
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R800.83
A6P6-O-phosphono-alpha-D-allopyranoseA,B,C,D,E2VVO0.77
F1P1-O-PHOSPHONO-BETA-D-FRUCTOPYRANOSEA,B2DF80.73
GCSD-GLUCOSAMINEA3CO40.84
GCSD-GLUCOSAMINEA1QGI0.84
GCSD-GLUCOSAMINEA,B2VZS0.84
GCSD-GLUCOSAMINEA1E9L0.84
GCSD-GLUCOSAMINEA,B,C,D3FXI0.84
GCSD-GLUCOSAMINEA,B2VZV0.84
GN12-(ACETYLAMINO)-2-DEOXY-1-O-PHOSPHONO-
ALPHA-D-GLUCOPYRANOSE
A2QKX0.76
GN12-(ACETYLAMINO)-2-DEOXY-1-O-PHOSPHONO-
ALPHA-D-GLUCOPYRANOSE
A,B2YQH0.76
GN12-(ACETYLAMINO)-2-DEOXY-1-O-PHOSPHONO-
ALPHA-D-GLUCOPYRANOSE
A,B2OI70.76
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B,C,D,E,F,
G,H
1UP60.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA2ZJ30.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B1HKB0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEX1U8X0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEX1P5G0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B2HO70.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA1GPY0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B2H0Z0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B1BG30.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B,C,D,E,F,
G,H
1UP70.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA2VEZ0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA2ACQ0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B,C,D1GZ50.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA1MOR0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B1QHA0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B1U0F0.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEA,B2Z740.77
G6PALPHA-D-GLUCOSE-6-PHOSPHATEN1CZA0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA,B,C,D1H5R0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA,B,C,D,E,F,
G,H
2UX80.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA,B,C,D,E,F,
G,H
1G230.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA2B0C0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA,B1L5V0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA,B,C,D,E,F,
G,H
1G0R0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA3GPB0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA1UXT0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEX3BKQ0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA1UXQ0.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEA,B1NT40.77
G1PALPHA-D-GLUCOSE-1-PHOSPHATEX1P5D0.77
PA1PAROMOMYCIN (RING 1)A1PBR0.84
PA1PAROMOMYCIN (RING 1)A1QKC0.84
PA1PAROMOMYCIN (RING 1)A1QFG0.84
PA1PAROMOMYCIN (RING 1)A1FI10.84
PA1PAROMOMYCIN (RING 1)A,B,C,D3FXI0.84
PA1PAROMOMYCIN (RING 1)A1QFF0.84
M1PALPHA-D-MANNOSE 1-PHOSPHATEA2FUE0.77
M1PALPHA-D-MANNOSE 1-PHOSPHATEX1PCJ0.77
M6D6-O-phosphono-beta-D-mannopyranoseA,B2RLB0.77
M6D6-O-phosphono-beta-D-mannopyranoseA,B2RL80.77
NNG2-DEOXY-2-{[(S)-HYDROXY(METHYL)PHOSPHORYL]AMINO}-
6-O-PHOSPHONO-ALPHA-D-GLUCOPYRANOSE
A,B2P530.88
G16ALPHA-D-GLUCOSE 1,6-BISPHOSPHATEA,B,C2I550.75
G16ALPHA-D-GLUCOSE 1,6-BISPHOSPHATEA1O030.75
G16ALPHA-D-GLUCOSE 1,6-BISPHOSPHATEA2FKF0.75
G16ALPHA-D-GLUCOSE 1,6-BISPHOSPHATEX2FKM0.75
G16ALPHA-D-GLUCOSE 1,6-BISPHOSPHATEA,B1C470.75
G16ALPHA-D-GLUCOSE 1,6-BISPHOSPHATEA1O080.75
SUPSUCROSE-6-PHOSHPATEA1U2T0.7
SUPSUCROSE-6-PHOSHPATEA2R680.7
TOA3-DEOXY-3-AMINO GLUCOSEA1TOB0.89
TOA3-DEOXY-3-AMINO GLUCOSEA2TOB0.89
RHA6-DEOXY-MANNOSE-1'-PHOSPHATEE,I1TLP0.75
AOG4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R820.79
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,D1I1D0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2DKC0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,C,D,E,F1NE70.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FS50.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2O280.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FRZ0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1HOT0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA2VXK0.76
N30(1R,2R,3S,4R,6S)-4,6-DIAMINO-2-
[(5-AMINO-5-DEOXY-BETA-D-RIBOFURANOSYL)OXY]-
3-HYDROXYCYCLOHEXYL 2-AMINO-2-DEOXY-
ALPHA-D-GLUCOPYRANOSIDE
B2O3X0.72
M7PD-GLYCERO-D-MANNOPYRANOSE-7-PHOSPHATEA,B1X920.74
GNSN-SULFO-ALPHA-D-GLUCOSAMINEA2ERM0.79
N33A2O3V0.72
MYGGLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOLA1GYM0.78
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1CPU0.86
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1NM90.86
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFV0.86
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1PIG0.86
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX1Z320.86
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFU0.86
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3BLK0.86
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX3BLP0.86
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3DHP0.86
H2PHEPTULOSE-2-PHOSPHATEA6GPB0.7
T6PTREHALOSE-6-PHOSPHATEA,B1BYK0.7
X1P1-O-PHOSPHONO-ALPHA-D-XYLOPYRANOSEX2H5A0.72
M6R5-AMINO-5-DEOXY-1-O-PHOSPHONO-D-
MANNITOL
A,B,C,D2PUV0.79
GP1GLUCOSAMINE 1-PHOSPHATEA,B,C1Q9W0.94
GP1GLUCOSAMINE 1-PHOSPHATEA,B2OI60.94
GP1GLUCOSAMINE 1-PHOSPHATEA2FCP0.94
GP1GLUCOSAMINE 1-PHOSPHATEA1FCP0.94
GP1GLUCOSAMINE 1-PHOSPHATEA1UJW0.94
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.84
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B,C,D,E,F1NE70.79
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA2ZJ40.79
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA1MOS0.79
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B1HOR0.79
RIORIBOSTAMYCINA,B1M4G0.72
RIORIBOSTAMYCINA,B3C3Z0.72
RIORIBOSTAMYCINA,B1S3Z0.72
RIORIBOSTAMYCINA,B,C,D2FCZ0.72
RIORIBOSTAMYCINA,B2ET50.72
RIORIBOSTAMYCINA,B3DVV0.72
RIORIBOSTAMYCINA2BUE0.72
TOYTOBRAMYCINA,B1M4D0.72
TOYTOBRAMYCINA,B1LC40.72
BG6BETA-D-GLUCOSE-6-PHOSPHATEA2CIR0.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B3BXG0.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B,C,D2POC0.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2PUW0.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEA1E7Y0.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2NZT0.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEA1E770.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2BHL0.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2Q8M0.77
BG6BETA-D-GLUCOSE-6-PHOSPHATEG,L2NZU0.77
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
B2F4S0.74
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
A,B2FCX0.74
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
B2ET80.74
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA2PIK0.86
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA6CGT0.86
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA,B1PIK0.86
GL6(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YL)-PHOSPHORAMIDIC ACID DIMETHYL ESTER
A1XC70.79
GP4GLUCOSAMINE 4-PHOSPHATEA1FCP0.94
GP4GLUCOSAMINE 4-PHOSPHATEA,B,C1Q9W0.94
GP4GLUCOSAMINE 4-PHOSPHATEA2FCP0.94
GLPGLUCOSAMINE 6-PHOSPHATEE,F,G,H,P,Q,
R,S
2NZ40.94
GLPGLUCOSAMINE 6-PHOSPHATEA1MOQ0.94
GLPGLUCOSAMINE 6-PHOSPHATEA3CXQ0.94
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4A0.94
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4C0.94
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4B0.94
GLPGLUCOSAMINE 6-PHOSPHATEA,B2VHL0.94
GLPGLUCOSAMINE 6-PHOSPHATEA,B2Z750.94
GLPGLUCOSAMINE 6-PHOSPHATEX2VF50.94
GLPGLUCOSAMINE 6-PHOSPHATEA,B2RI10.94
TOC2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSEA2TOB0.81
TOC2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSEA1TOB0.81
D6G2-DEOXY-GLUCOSE-6-PHOSPHATEA2PRI0.77
9CS(1R,2S,3S,4R,6S)-4,6-DIAMINO-3-
[(3-AMINO-3-DEOXY-ALPHA-D-GLUCOPYRANOSYL)OXY]-
2-HYDROXYCYCLOHEXYL 2,6-DIAMINO-
2,6-DIDEOXY-ALPHA-D-GLUCOPYRANOSIDE
A2QIR0.72
BGPBETA-GALACTOSE-6-PHOSPHATEA,B4PBG0.77
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A,B1NAA0.71
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A2AXR0.71
KNCKANAMYCIN CA1V0C0.72
VG1ALPHA-D-GLUCOSE-1-PHOSPHATE-6-VANADATEA1C4G0.77
GFP2-DEOXY-2-FLUORO-ALPHA-D-GLUCOSE-
1-PHOSPHATE
A4GPB0.74
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1QD30.85
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1NEM0.85
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1PBR0.85
GE13,4-DIDEOXY-2,6-AMINO-ALPHA-D GALACTOPYRANOSEA1BYJ0.75
GCN3-DEOXY-D-GLUCOSAMINEA1FI10.84
GCN3-DEOXY-D-GLUCOSAMINEA1QFG0.84
GCN3-DEOXY-D-GLUCOSAMINEA1QKC0.84
GCN3-DEOXY-D-GLUCOSAMINEA,B2GRX0.84
GCN3-DEOXY-D-GLUCOSAMINEA1QJQ0.84
GCN3-DEOXY-D-GLUCOSAMINEA1QFF0.84
GL11-O-phosphono-alpha-D-galactopyranoseA,B1Z4N0.77
GL11-O-phosphono-alpha-D-galactopyranoseA,B1Z4O0.77
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ90.75
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ40.75
GPH4-O-phosphono-D-glycero-beta-D-
manno-heptopyranose
A1FCP0.74
GPO4-O-phosphono-D-glycero-beta-D-
manno-heptopyranose
A2FCP0.74
MURMURAMIC ACIDA,C,E,G1LOD0.72