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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02453797

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.75
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.75
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.75
DR4METHYL 9-(BETA-D-TALOPYRANOSYLOXY)NONANOATEA1ZJO0.75
DR4METHYL 9-(BETA-D-TALOPYRANOSYLOXY)NONANOATEA1ZJP0.75
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B2FAF0.74
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B,C,D2FAH0.74
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B2QZY0.74
DSU((2R,3S,4S,5S)-3,4-DIHYDROXY-5-
(HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)-
3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO-
2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN-
2-YL)METHYL NONANOATE
A,B2FCT0.74
DSU((2R,3S,4S,5S)-3,4-DIHYDROXY-5-
(HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)-
3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO-
2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN-
2-YL)METHYL NONANOATE
A,B2FCV0.74
DSU((2R,3S,4S,5S)-3,4-DIHYDROXY-5-
(HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)-
3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO-
2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN-
2-YL)METHYL NONANOATE
A,B2FCU0.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVK0.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2DWD0.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEC2DWE0.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVJ0.74
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Y0.74
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Z0.74
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.74
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.74
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.74
OSUN-OCTANOYLSUCROSEA1PYY0.74
2OS3-N-OCTANOYLSUCROSEA,B1T3I0.74
DGADIACYL GLYCEROLA,C2NLJ0.73
DGADIACYL GLYCEROLA,C1ZWI0.73
DGADIACYL GLYCEROLB,C1R3J0.73
DGADIACYL GLYCEROLC1K4D0.73
DGADIACYL GLYCEROLA,C1K4C0.73
DGADIACYL GLYCEROLC1R3K0.73
DGADIACYL GLYCEROLB,C1S5H0.73
DGADIACYL GLYCEROLC,H1R3I0.73
DGADIACYL GLYCEROLB,C1R3L0.73
LMG1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDEA,B,C,F,I,J,
K,L,M,X
1JB00.73
LMG1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDEA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.73
LMG1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDEA,B,C,D,L,R1Q900.73
LMG1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDEA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.73
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.73
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.73
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.73
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.73
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.73
MGE(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)-
1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE
A,B,C,D,F,H,
K,L,T,V,Z
3A0H0.73
MGE(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)-
1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE
A,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.73
MGE(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)-
1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE
A,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.73
ERI4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-
BETA-L-ARABINO-HEXOPYRANOSE
A,B1D830.72
ERI4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-
BETA-L-ARABINO-HEXOPYRANOSE
A,B1EKH0.72
ERI4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-
BETA-L-ARABINO-HEXOPYRANOSE
A,B1EKI0.72
ERI4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-
BETA-L-ARABINO-HEXOPYRANOSE
A,B,C,D1VAQ0.72
DGG1-[GLYCEROLYLPHOSPHONYL]-2-[8-(2-
HEXYL-CYCLOPROPYL)-OCTANAL-1-YL]-
3-[HEXADECANAL-1-YL]-GLYCEROL
A,B1CQX0.72
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A2C9E0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)M,N,O1PPR0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C2BHW0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
G,H,I,J
1RWT0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,F,H,
K,L,T,V,Z
3A0H0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.71
PII2-[(HYDROXY{[(2R,3R,5S,6R)-2,3,4,5,6-
PENTAHYDROXYCYCLOHEXYL]OXY}PHOSPHORYL)OXY]-
1-[(PALMITOYLOXY)METHYL]ETHYL HEPTADECANOATE
A1GZQ0.71