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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02761513

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.77
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A,B1NAA0.73
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A2AXR0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5Q0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEM0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5R0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1EXV0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5S0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L7X0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA1WW20.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA2PRJ0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1FC00.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEJ0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEH0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1XOI0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DDW0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1EM60.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DDS0.8
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DD10.8
TYUTETRAHYDROURIDINEA,B,C,D2FR50.71
H4P1-DEOXY-6-O-PHOSPHONO-1-[(PHOSPHONOMETHYL)AMINO]-
L-THREO-HEXITOL
A,B1PCW0.7
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol
A,B2VL40.72
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE
A3CUF0.73
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE
A,B2OYK0.73
ISXGLUCOSE BETA-1,3-ISOFAGAMINEA2BVD0.73
AZCA1KTI0.76
7GPETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3S0.72
NCW(1S,2R,3S,4R,5R)-2,3,4-trihydroxy-
N-octyl-6-oxa-8-azabicyclo[3.2.1]octane-
8-carbothioamide
A,B2VRJ0.73
GL6(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YL)-PHOSPHORAMIDIC ACID DIMETHYL ESTER
A1XC70.73
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE
A2BWM0.73
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE
A1O9V0.73
DL62-AZIDO-N-((2R,3R,4S,5S,6R)-3,4,5-
TRIHYDROXY-6-(HYDROXYMETHYL)-TETRAHYDRO-
2H-PYRAN-2-YL)ACETAMIDE
A2FFR0.75
4GPN-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACIDA2F3P0.73
6GPMETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3Q0.71
233[5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YLCARBAMOYL)-
PENTYL]-CARBAMIC ACID METHYL ESTER
D,E,F,G,H1MD20.74
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A2JCQ0.71
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B2IH90.71
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B,C,D,E,F2J2P0.71
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A3DIV0.71
CR11-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCOPYRANOSE
A1FU70.81
MYGGLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOLA1GYM0.7
C4B1-beta-D-glucopyranosyl-1,3,5-triazinane-
2,4,6-trione
A3BDA0.71
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2J750.72
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A2V3G0.72
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2VQU0.72
NTFN-TRIFLURO-ACETYL-BETA-D-GLUCOPYRANOSYLAMINEA1WW30.77
8GPA2F3U0.73
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.74
NOJ1-DEOXYNOJIRIMYCINA,B2J770.74
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.74
NOJ1-DEOXYNOJIRIMYCINA3GBE0.74
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.74
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.74
NOJ1-DEOXYNOJIRIMYCINA1DOG0.74
NOJ1-DEOXYNOJIRIMYCINA,B1I750.74
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.74
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.74
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.74
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.74
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.74
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A2ALW0.72
G2I(3R,4R,5R)-3-hydroxy-5-(hydroxymethyl)piperidin-
4-yl 4-O-beta-D-glucopyranosyl-
beta-D-glucopyranoside
A3CUH0.7
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R
2HIL0.71
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A2HI20.71
NA1METHYL N-ACETYL ALLOSAMINEA1HKJ0.71
NA1METHYL N-ACETYL ALLOSAMINEA,B3FY10.71
NA1METHYL N-ACETYL ALLOSAMINEA1HKI0.71
DR36-DEOXY-ALPHA-L-GLUCOPYRANOSYL-
(1->2)-BETA-D-GULOPYRANOSYL-(1-
>3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]-
ALPHA-L-TALOPYRANOSE
A1ZJ20.71
DR36-DEOXY-ALPHA-L-GLUCOPYRANOSYL-
(1->2)-BETA-D-GULOPYRANOSYL-(1-
>3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]-
ALPHA-L-TALOPYRANOSE
A1ZI50.71