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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206767

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GP4GLUCOSAMINE 4-PHOSPHATEA1FCP0.7
GP4GLUCOSAMINE 4-PHOSPHATEA,B,C1Q9W0.7
GP4GLUCOSAMINE 4-PHOSPHATEA2FCP0.7
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE
A,B,C,D1N470.78
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE
A2CGZ0.78
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE
A,B,C,D2D3S0.78
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE
A2D7R0.78
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1QD30.75
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
B1O9M0.75
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1NEM0.75
AR42-AMINO-5-(3-FLUORO-3,4-DIHYDROXY-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
2-YLOXY)-5-HYDROXY-PENTANOIC ACID
A,B,C1S2D0.78
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1CPU0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1NM90.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFV0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1PIG0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX1Z320.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFU0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3BLK0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX3BLP0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3DHP0.76
TOC2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSEA2TOB0.74
TOC2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSEA1TOB0.74
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ90.76
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ40.76
GP1GLUCOSAMINE 1-PHOSPHATEA,B,C1Q9W0.7
GP1GLUCOSAMINE 1-PHOSPHATEA,B2OI60.7
GP1GLUCOSAMINE 1-PHOSPHATEA2FCP0.7
GP1GLUCOSAMINE 1-PHOSPHATEA1FCP0.7
GP1GLUCOSAMINE 1-PHOSPHATEA1UJW0.7
MYGGLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOLA1GYM0.79
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE
A2J8G0.73
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE
A2J8F0.73
IN1PROPIONIC ACID 2,2-DIHYDROXY-3-
(1-GLUCOPYRANOSYLOXY)-METHYLPROPYL ESTER
A,B4OVW0.75
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7Y0.81
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7X0.81
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R810.81
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7V0.81
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R800.81
SGNN,O6-DISULFO-GLUCOSAMINEA,B1FQ90.7
SGNN,O6-DISULFO-GLUCOSAMINEB2AXM0.7
SGNN,O6-DISULFO-GLUCOSAMINEA,B1GMN0.7
SGNN,O6-DISULFO-GLUCOSAMINEA,B1T8U0.7
SGNN,O6-DISULFO-GLUCOSAMINEA1BFB0.7
SGNN,O6-DISULFO-GLUCOSAMINEB,D,F,H1XMN0.7
SGNN,O6-DISULFO-GLUCOSAMINEA,B,C,D,E,F,
G,H
1GMO0.7
SGNN,O6-DISULFO-GLUCOSAMINEA,B,C,D,E,F1AXM0.7
SGNN,O6-DISULFO-GLUCOSAMINEA1XT30.7
SGNN,O6-DISULFO-GLUCOSAMINE11QQP0.7
SGNN,O6-DISULFO-GLUCOSAMINEA,B1RID0.7
SGNN,O6-DISULFO-GLUCOSAMINEA1G5N0.7
SGNN,O6-DISULFO-GLUCOSAMINEA,B2BRS0.7
SGNN,O6-DISULFO-GLUCOSAMINEA1HPN0.7
SGNN,O6-DISULFO-GLUCOSAMINEA1ZA40.7
SGNN,O6-DISULFO-GLUCOSAMINE11ZBA0.7
SGNN,O6-DISULFO-GLUCOSAMINEA1BFC0.7
SGNN,O6-DISULFO-GLUCOSAMINEA,B,C,D2VRA0.7
SGNN,O6-DISULFO-GLUCOSAMINEA2HYV0.7
SGNN,O6-DISULFO-GLUCOSAMINEH,I3B9F0.7
SGNN,O6-DISULFO-GLUCOSAMINEA,B3DY00.7
SGNN,O6-DISULFO-GLUCOSAMINEA2HYU0.7
SGNN,O6-DISULFO-GLUCOSAMINEB,C,D,E1E0O0.7
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA2PIK0.76
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA6CGT0.76
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA,B1PIK0.76
KANKANAMYCIN AA1L8T0.72
KANKANAMYCIN AA,B1M4I0.72
KANKANAMYCIN AA,B1ND40.72
KANKANAMYCIN AA,B1KNY0.72
KANKANAMYCIN AA,B2ESI0.72
PARPAROMOMYCINA1FYP0.71
PARPAROMOMYCINV,Z2J020.71
PARPAROMOMYCINZ2UXD0.71
PARPAROMOMYCINA,D,N,Y,Z1N330.71
PARPAROMOMYCINV,Y,Z2WDM0.71
PARPAROMOMYCINY,Z2VQE0.71
PARPAROMOMYCINA,D,L,N1IBK0.71
PARPAROMOMYCINZ2UXB0.71
PARPAROMOMYCINY,Z2UU90.71
PARPAROMOMYCINZ2UXC0.71
PARPAROMOMYCINA,D,N,X1XMQ0.71
PARPAROMOMYCINB2O3W0.71
PARPAROMOMYCINV,Y,Z2WDG0.71
PARPAROMOMYCINA2Z4K0.71
PARPAROMOMYCIN4,B2Z4N0.71
PARPAROMOMYCINV,Y,Z2WDK0.71
PARPAROMOMYCINA,E2Z4M0.71
PARPAROMOMYCINA,B,C,D3BNQ0.71
PARPAROMOMYCINY,Z2UUB0.71
PARPAROMOMYCINA,D,H,N1FJG0.71
PARPAROMOMYCINA,B1J7T0.71
PARPAROMOMYCINY,Z2UUA0.71
PARPAROMOMYCINY,Z2UUC0.71
PARPAROMOMYCINA,D,J,N,X1XNQ0.71
PARPAROMOMYCINA,D,E,J,M,N,Y1N320.71
PARPAROMOMYCINA2VQY0.71
PARPAROMOMYCINA,B3C440.71
PARPAROMOMYCINV,Z2J000.71
PARPAROMOMYCIN4,B2Z4L0.71
PARPAROMOMYCINV,Y,Z2WDH0.71
PARPAROMOMYCINA,D,J,N,Y1IBL0.71
PARPAROMOMYCINA,B,C,D3BNR0.71
PARPAROMOMYCINA,D,J,N,X1XMO0.71
PARPAROMOMYCINY,Z2VQF0.71
PARPAROMOMYCINA,D,J,N,X1XNR0.71
GCSD-GLUCOSAMINEA3CO40.74
GCSD-GLUCOSAMINEA1QGI0.74
GCSD-GLUCOSAMINEA,B2VZS0.74
GCSD-GLUCOSAMINEA1E9L0.74
GCSD-GLUCOSAMINEA,B,C,D3FXI0.74
GCSD-GLUCOSAMINEA,B2VZV0.74
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
A,B2VS40.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
A1W3G0.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
A,B3EHN0.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
A1W3F0.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
A1ZJ10.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
A2YY10.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
A1ZI30.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
A,B2VS30.7
GNSN-SULFO-ALPHA-D-GLUCOSAMINEA2ERM0.71
RHC5-(3-AMINO-4,4-DIHYROXY-BUTYLSULFANYLMETHYL)-
TETRAHYDRO-FURAN-2,3,4-TRIOL
A1JVI0.7
LPSO-{HYDROXY[((2R)-2-HYDROXY-3-{[(1S)-
1-HYDROXYPENTADECYL]OXY}PROPYL)OXY]PHOSPHORYL}-
L-SERINE
A1NL20.75
PA1PAROMOMYCIN (RING 1)A1PBR0.74
PA1PAROMOMYCIN (RING 1)A1QKC0.74
PA1PAROMOMYCIN (RING 1)A1QFG0.74
PA1PAROMOMYCIN (RING 1)A1FI10.74
PA1PAROMOMYCIN (RING 1)A,B,C,D3FXI0.74
PA1PAROMOMYCIN (RING 1)A1QFF0.74
MURMURAMIC ACIDA,C,E,G1LOD0.79
MGS1,2-O-DIMETHYL-4-[2,4-DIHYDROXY-
BUTYRAMIDO]-4,6-DIDEOXY-ALPHA-D-
MANNOPYRANOSIDE
H1F4X0.72
GLPGLUCOSAMINE 6-PHOSPHATEE,F,G,H,P,Q,
R,S
2NZ40.7
GLPGLUCOSAMINE 6-PHOSPHATEA1MOQ0.7
GLPGLUCOSAMINE 6-PHOSPHATEA3CXQ0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4A0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4C0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4B0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B2VHL0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B2Z750.7
GLPGLUCOSAMINE 6-PHOSPHATEX2VF50.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B2RI10.7
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
GTH3-O-GLUCOPYRANOSYL-THREONINE-[2-
DEOXY-2-ACETAMIDO-GLUCOPYRANOSIDE]
A1WCT0.74
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
B2F4S0.75
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,B2FCX0.75
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
B2ET80.75
N33A2O3V0.72
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.74
TOA3-DEOXY-3-AMINO GLUCOSEA1TOB0.76
TOA3-DEOXY-3-AMINO GLUCOSEA2TOB0.76
GDA4-DEOXY-4-AMINO-BETA-D-GLUCOSEA,B1OCB0.77
RIORIBOSTAMYCINA,B1M4G0.72
RIORIBOSTAMYCINA,B3C3Z0.72
RIORIBOSTAMYCINA,B1S3Z0.72
RIORIBOSTAMYCINA,B,C,D2FCZ0.72
RIORIBOSTAMYCINA,B2ET50.72
RIORIBOSTAMYCINA,B3DVV0.72
RIORIBOSTAMYCINA2BUE0.72
KSG(1S,2R,3S,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXYL 2-
AMINO-4-{[CARBOXY(IMINO)METHYL]AMINO}-
2,3,4,6-TETRADEOXY-ALPHA-D-ARABINO-
HEXOPYRANOSIDE
A1VS70.71
KSG(1S,2R,3S,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXYL 2-
AMINO-4-{[CARBOXY(IMINO)METHYL]AMINO}-
2,3,4,6-TETRADEOXY-ALPHA-D-ARABINO-
HEXOPYRANOSIDE
A2HHH0.71
KSG(1S,2R,3S,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXYL 2-
AMINO-4-{[CARBOXY(IMINO)METHYL]AMINO}-
2,3,4,6-TETRADEOXY-ALPHA-D-ARABINO-
HEXOPYRANOSIDE
A1VS50.71
TOYTOBRAMYCINA,B1M4D0.72
TOYTOBRAMYCINA,B1LC40.72
EAG2-aminoethyl 2-(acetylamino)-2-
deoxy-beta-D-glucopyranoside
B,D,E,F,H3BZ40.7
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
AMUBETA-N-ACETYLMURAMIC ACIDA,B,C,D2APH0.71
AMUBETA-N-ACETYLMURAMIC ACIDA,P1TWQ0.71
AMUBETA-N-ACETYLMURAMIC ACIDA1D0K0.71
AMUBETA-N-ACETYLMURAMIC ACIDS9LYZ0.71
AMUBETA-N-ACETYLMURAMIC ACIDE,S148L0.71
AMUBETA-N-ACETYLMURAMIC ACIDD,K3CYQ0.71
AMUBETA-N-ACETYLMURAMIC ACIDU2AIZ0.71
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
AEITHREONINE-ASPARTIC ESTERA,B,C,D4ECA0.74
KNCKANAMYCIN CA1V0C0.72
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1M7D0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1LED0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1GSL0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1FWU0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA,B,C,D1G1R0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1FWV0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA1G1T0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINE1,2,33KMB0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINE1,2,32KMB0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA,B1ZPL0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINE1,2,34KMB0.71
MAGBETA-METHYL-N-ACETYL-D-GLUCOSAMINEA,H1UZ80.71
NMYNEOMYCINA2B0Q0.71
NMYNEOMYCIN4,B2QP10.71
NMYNEOMYCINA,B2ET40.71
NMYNEOMYCINA,E,N2QAN0.71
NMYNEOMYCINA,B2FCY0.71
NMYNEOMYCINA2QP00.71
NMYNEOMYCINA1I9V0.71
NMYNEOMYCINA2QAL0.71
NMYNEOMYCIN4,B2QOZ0.71
NMYNEOMYCINA,C2A040.71
NMYNEOMYCINA1EI20.71
NMYNEOMYCINA,B3C7R0.71
NMYNEOMYCIN4,B2QAM0.71
NMYNEOMYCIN4,B2QAO0.71
NMYNEOMYCINA2QOY0.71
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA,C,E,G1UH10.71
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA,B,C,D2DU10.71
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA,C,E,G1UH00.71
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA,B,C,D2DVA0.71
MGCALPHA-METHYL-N-ACETYL-D-GALACTOSAMINEA1UGX0.71
AOG4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R820.77
GCN3-DEOXY-D-GLUCOSAMINEA1FI10.74
GCN3-DEOXY-D-GLUCOSAMINEA1QFG0.74
GCN3-DEOXY-D-GLUCOSAMINEA1QKC0.74
GCN3-DEOXY-D-GLUCOSAMINEA,B2GRX0.74
GCN3-DEOXY-D-GLUCOSAMINEA1QJQ0.74
GCN3-DEOXY-D-GLUCOSAMINEA1QFF0.74
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1QD30.75
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1NEM0.75
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1PBR0.75
MUBN-ACETYLMURAMIC ACIDL,N1WCO0.71