Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00011858

Ligand	Ligand name	Chain	PDB	Tanimoto
4AT	5-OXOHEXANOIC ACID	A,B	2EFY	0.72
GLR	2,3-DIHYDROXY-5-OXO-HEXANEDIOATE	A,B,C,D	1EC8	0.71
GLR	2,3-DIHYDROXY-5-OXO-HEXANEDIOATE	A,B,C,D	1JDF	0.71
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDRO-2H-PYRAN-2-ONE	M	1E6X	0.7
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDRO-2H-PYRAN-2-ONE	A,B	2E40	0.7
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDRO-2H-PYRAN-2-ONE	A	2VWG	0.7
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDRO-2H-PYRAN-2-ONE	A,B	3EQO	0.7
GCO	GLUCONIC ACID	B,C,D	1BGG	0.78
GCO	GLUCONIC ACID	A,B	1XLF	0.78
LAC	LACTIC ACID	A	2FLT	0.74
LAC	LACTIC ACID	A	2IMP	0.74
LAC	LACTIC ACID	A	1C0Q	0.74
LAC	LACTIC ACID	E,I,P	1P11	0.74
LAC	LACTIC ACID	A,B	2NLI	0.74
LAC	LACTIC ACID	A,B,C,D	2PI1	0.74
LAC	LACTIC ACID	A	1C0R	0.74
LAC	LACTIC ACID	A	1UHD	0.74
LAC	LACTIC ACID	C,D	1AXD	0.74
LAC	LACTIC ACID	A	1QH9	0.74
LAC	LACTIC ACID	A	2P1E	0.74
LAC	LACTIC ACID	A	1K87	0.74
LAC	LACTIC ACID	E,I	1P12	0.74
LAC	LACTIC ACID	A	1W3Q	0.74
LAC	LACTIC ACID	A	1C0K	0.74
LAC	LACTIC ACID	A,B	2FN7	0.74
LAC	LACTIC ACID	A	1TJ1	0.74
LAC	LACTIC ACID	A	1TJ0	0.74
HOC	(2S)-2-HYDROXYOCTANOIC ACID	A	2A85	0.87
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2HFE	0.73
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2H8P	0.73
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2HG5	0.73
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	1JZ5	0.7
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	3CZJ	0.7
1N5	(2R,4S)-2,4,7-trihydroxyheptanoic acid	A,B	3CXO	0.83
SHV	HEPTANOIC ACID	A	1PO8	0.71
SSH	3-DEOXY-D-ARABINO-HEXONIC ACID	A,B,C,D	1W3N	0.81
CS2	D-MANNONIC ACID	A,B,C,D	2QJM	0.78
CS2	D-MANNONIC ACID	A,B	3DBN	0.78
VAD	DEAMINOHYDROXYVALINE	C	1CWO	0.79
KDG	2-KETO-3-DEOXYGLUCONATE	A,B	1V1A	0.76
KDG	2-KETO-3-DEOXYGLUCONATE	A,B,C	2VAR	0.76
KDG	2-KETO-3-DEOXYGLUCONATE	A,B,C,D	2QJN	0.76
LGT	L-GLUCARIC ACID	A,B,C,D	3CB3	0.76
LGT	L-GLUCARIC ACID	A,B,C	2PP3	0.76
DDR	(2S)-3-hydroxypropane-1,2-diyl didecanoate	A	2Z9Y	0.71
DDR	(2S)-3-hydroxypropane-1,2-diyl didecanoate	A	2Z9Z	0.71
TFB	TETRAHYDROFURAN-2-CARBOXYLIC ACID	A	1TIW	0.72
TFB	TETRAHYDROFURAN-2-CARBOXYLIC ACID	A	3E2R	0.72
TFB	TETRAHYDROFURAN-2-CARBOXYLIC ACID	A	1KB0	0.72
1EM	(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE	C	2IH1	0.71
1EM	(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE	C	2IH3	0.71
1EM	(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE	A,C	2P7T	0.71
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN-2-CARBOXYLIC ACID	A	1RWG	0.72
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN-2-CARBOXYLIC ACID	A	1RWF	0.72
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN-2-CARBOXYLIC ACID	A	1RWH	0.72
SHO	5-HYDROXYLAEVULINIC ACID	A	1W31	0.71
1LU	4-METHYL-PENTANOIC ACID-2-OXYL GROUP	E,I	6TMN	0.84
1LU	4-METHYL-PENTANOIC ACID-2-OXYL GROUP	I	1DS2	0.84
HXD	(3R)-3-HYDROXYDODECANOIC ACID	A	2DDH	0.73
3LR	3,6-dideoxy-L-arabino-hexonic acid	A,B	3CXO	0.83
RSH	3-DEOXY-D-LYXO-HEXONIC ACID	A,B,C,D	1W3T	0.81
FTT	3-HYDROXY-TETRADECANOIC ACID	A	1QFF	0.73
FTT	3-HYDROXY-TETRADECANOIC ACID	A	1QJQ	0.73
FTT	3-HYDROXY-TETRADECANOIC ACID	A,B	2GRX	0.73
FTT	3-HYDROXY-TETRADECANOIC ACID	A	1QFG	0.73
FTT	3-HYDROXY-TETRADECANOIC ACID	A	1QKC	0.73
FTT	3-HYDROXY-TETRADECANOIC ACID	A	1FI1	0.73
FTT	3-HYDROXY-TETRADECANOIC ACID	A,B,C,D	3FXI	0.73
PAF	PANTOATE	A,B	2OFP	0.7
PAF	PANTOATE	A,B	1N2E	0.7
PAF	PANTOATE	A,B	1N2B	0.7
PAF	PANTOATE	A,B	1N2J	0.7
L2C	(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE	A,C	2HVK	0.71
L2C	(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE	A,C	2DWD	0.71
L2C	(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE	C	2DWE	0.71
L2C	(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE	A,C	2HVJ	0.71
12H	12-HYDROXYDODECANOIC ACID	A,B	1M6W	0.71
2OP	(2S)-2-HYDROXYPROPANOIC ACID	A,B,C,D	2VK8	0.74
2OP	(2S)-2-HYDROXYPROPANOIC ACID	0,1,3,4,9,A,B,C,H,J,K,L,M,N,O,Q,R,S,T,U,Y,Z	1VQ7	0.74
2OP	(2S)-2-HYDROXYPROPANOIC ACID	0,1,3,4,9,A,B,C,H,J,K,L,M,N,O,Q,R,S,T,U,Y,Z	1VQ4	0.74
2OP	(2S)-2-HYDROXYPROPANOIC ACID	A,C,E	2VOJ	0.74
2OP	(2S)-2-HYDROXYPROPANOIC ACID	0,1,2,3,4,9,A,B,C,H,J,K,L,M,N,O,Q,R,S,T,U,Y,Z	1VQ5	0.74
2OP	(2S)-2-HYDROXYPROPANOIC ACID	A	1W9N	0.74
GKR	D-GLUCARATE	A	3CXT	0.76
GKR	D-GLUCARATE	A,B	1JCT	0.76
RNS	L-RHAMNOSE	A,B,C,D	1X8D	0.71
RNS	L-RHAMNOSE	A,B,C,D	1DE6	0.71
RNS	L-RHAMNOSE	A,B,C,D	2I56	0.71
DMV	2,3-DIHYDROXY-VALERIANIC ACID	A,B,C,D	1QMG	0.77
LFC	6-DEOXY-L-GALACTONIC ACID	A	2HXU	0.8
DXG	4-DEOXYGLUCARATE	A,B,C,D	1ECQ	0.78
GVM	(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACID	A,B	2UW1	0.7
6NA	HEXANOIC ACID	A,B	2IX4	0.77
6NA	HEXANOIC ACID	A,B	2IWZ	0.77
6NA	HEXANOIC ACID	A	2IQ0	0.77