Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02313489

Ligand	Ligand name	Chain	PDB	Tanimoto
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B	2TPL	0.77
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B,C,D	3GGP	0.77
OHT	4-HYDROXYTAMOXIFEN	A	3ERT	0.7
OHT	4-HYDROXYTAMOXIFEN	A,B	1S9Q	0.7
OHT	4-HYDROXYTAMOXIFEN	A,B	1VJB	0.7
OHT	4-HYDROXYTAMOXIFEN	A,B,C,P,R	2JF9	0.7
OHT	4-HYDROXYTAMOXIFEN	A,B,C,D,E,F	2GPV	0.7
OHT	4-HYDROXYTAMOXIFEN	A	2GPU	0.7
OHT	4-HYDROXYTAMOXIFEN	A	2P7Z	0.7
OHT	4-HYDROXYTAMOXIFEN	A,B	2BJ4	0.7
OHT	4-HYDROXYTAMOXIFEN	A,B	2FSZ	0.7
4HC	4-HYDROXY-2H-CHROMEN-2-ONE	A,B	1V5Y	0.76
TOM	4-(2-METHOXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IMF	0.78
5TN	(2E)-3-[4-HYDROXY-3-(5,5,8,8-TETRAMETHYL-3-PROPOXY-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PHENYL]ACRYLIC ACID	A	2P1V	0.75
R12	9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID	A	3CBS	0.75
667	6-OXO-8,9,10,11-TETRAHYDRO-7H-CYCLOHEPTA[C][1]BENZOPYRAN-3-O-SULFAMATE	A	1TTM	0.74
AJA	(6AR,10AR)-3-(1,1-DIMETHYLHEPTYL)-1-HYDROXY-6,6-DIMETHYL-6A,7,10,10A-TETRAHYDRO-6H-BENZO[C]CHROMENE-9-CARBOXYLIC ACID	A,B,C,D	2OM9	0.74
TF5	2-[(2',3',4'-TRIFLUOROBIPHENYL-2-YL)OXY]ETHANOL	A,B	2OP3	0.74
T4A		C,D	1KGI	0.79
T4A		A,B	1Z7J	0.79
4HP	4-HYDROXYPHENYLACETATE	A,B,C,D	2JBT	0.77
4HP	4-HYDROXYPHENYLACETATE	A	2YYJ	0.77
4HP	4-HYDROXYPHENYLACETATE	A	2YYM	0.77
4HP	4-HYDROXYPHENYLACETATE	B	1AI6	0.77
4HP	4-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCG	0.77
L41	{4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid	A,B	3D5F	0.73
OMD	2-(3,6-DIHYDROXYPHENYL)ACETIC ACID	A,B	1AJP	0.73
OAC	TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE	C	3GCH	0.74
4BR	2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE	A	1PE7	0.72
MTJ	N,O-DIMETHYL-L-TYROSINE	A,B	1ATL	0.73
DH2	(2S,3S)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP5	0.71
DH2	(2S,3S)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP6	0.71
IKR	methyl (2E)-{2-[(4-iodo-2,5-dimethylphenoxy)methyl]phenyl}(methoxyimino)ethanoate	A,C,D,E,N,P,Q,R	3H1K	0.72
REF	2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione	A	2ZJW	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F	3BXX	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	2O3P	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B	2UXH	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	1GP6	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	2C9Z	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F,G,H,I,J,K,L,M,N	2JJ2	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	3BPT	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F	3CF8	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B	2HCK	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D	1H1I	0.71
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	1E8W	0.71
C41	ALISKIREN	C,O	2V0Z	0.72
B76		A,B	2E9D	0.73
ESM	1,3,5(10)-ESTRATRIEN-2,3,17-BETA-TRIOL 2-METHYL ETHER	A	1LHW	0.71
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3B3K	0.83
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3D6D	0.83
BHP	(S)-5-(4-BENZYLOXY-PHENYL)-4-(7-PHENYL-HEPTANOYLAMINO)-PENTANOIC ACID	A,B	1J1A	0.71
JPN	2-(2,4-DICHLOROPHENOXY)-5-(3-PHENYLPROPYL)PHENOL	A,B	2OL4	0.71
ANM	ANISOMYCIN	1,2,4,A,B,C,D,E,J,K,L,M,N,O,P,R,S,T,U,V,Z	1K73	0.71
ANM	ANISOMYCIN	0,1,3,9,A,B,C,F,H,J,K,L,M,N,O,Q,R,S,T,U,Y,Z	3CC4	0.71
3TN	(2E)-3-[4-HYDROXY-3-(3-METHOXY-5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PHENYL]ACRYLIC ACID	A	2P1T	0.74
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2QZZ	0.9
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2R2G	0.9
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3GCL	0.8
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2QQT	0.8
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1TGM	0.8
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2G5J	0.8
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1OXR	0.8
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3HWY	0.8
JPJ	2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL	A,B	2OOS	0.71
JPJ	2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL	A	3FNH	0.71
MAX	MATAIRESINOL	A	2BGM	0.87
4SR	(4S)-4-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]PYRROLIDIN-2-ONE	A,B	1XN0	0.71
WRS	4-HYDROXY-3-[(1S,3S)-3-HYDROXY-1-PHENYLBUTYL]-2H-CHROMEN-2-ONE	A	1HA2	0.77
JPM	5-benzyl-2-(2,4-dichlorophenoxy)phenol	A,B,C,D	3FNF	0.7
RWF	R-WARFARIN	A,B	2BXD	0.78
FC3	5-[2-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID	A	2EVC	0.72
PFI	(6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO-4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY-5,6-DIHYDRO-2H-PYRAN-2-ONE	A	2HAI	0.78
261	2-ethoxyphenol	X	2RB1	0.74
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.7
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.7
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.7
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.7
EAA	ETHACRYNIC ACID	A,B	3DGQ	0.71
EAA	ETHACRYNIC ACID	A,B	11GS	0.71
EAA	ETHACRYNIC ACID	A,B,C,D	1GSF	0.71
EAA	ETHACRYNIC ACID	A,B	2GSS	0.71
EAA	ETHACRYNIC ACID	A,B	3GSS	0.71
EAA	ETHACRYNIC ACID	A,B	1GSE	0.71
JPL	5-(cyclohexa-1,5-dien-1-ylmethyl)-2-(2,4-dichlorophenoxy)phenol	A	3FNG	0.71
DAH	3,4-DIHYDROXYPHENYLALANINE	A,B	1RNR	0.7
DAH	3,4-DIHYDROXYPHENYLALANINE	A	6PAH	0.7
DAH	3,4-DIHYDROXYPHENYLALANINE	A,B	1IVV	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,C,E	1KYZ	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1JT2	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	6ATJ	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B	1GKL	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1GWT	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B,C	2BJH	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1GW2	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	3CBG	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	2BNJ	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B	1UWC	0.83
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	7ATJ	0.83
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PIT	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ1	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PIU	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PKL	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A,B	3D57	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ2	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2QPY	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ0	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NUO	0.81
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A,B	2PIN	0.81
BR3	(6-METHYL-3,4-DIHYDRO-2H-CHROMEN-2-YL)METHYLPHOSPHINATE	A	1PE5	0.7
BP7	1,1'-BIPHENYL-3,4-DIOL	A	2EI0	0.7
HIB	4-HYDROXY-5-IODO-2,3-DIMETHOXY-6-METHYLBENZOIC ACID	A	2PIK	0.7
NCZ	2-HYDROXY-7-METHOXY-5-METHYL-NAPHTHALENE-1-CARBOXYLIC ACID MESO-2,5-DIHYDROXY-CYCLOPENT-3-ENYL ESTER	A	1J5I	0.72
WRR	4-HYDROXY-3-[(1S,3R)-3-HYDROXY-1-PHENYLBUTYL]-2H-CHROMEN-2-ONE	A	1H9Z	0.77
34C	(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID	A,B	1HT8	0.79
ROL	ROLIPRAM	A,B,C,D	1OYN	0.71
ROL	ROLIPRAM	A,B	1XMY	0.71
ROL	ROLIPRAM	A,B,C,D	1Q9M	0.71
ROL	ROLIPRAM	A,B	1RO6	0.71
ROL	ROLIPRAM	A,B	1XN0	0.71
ROL	ROLIPRAM	A,B	1TBB	0.71
BVL	(2E)-1-[2-hydroxy-4-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one	A	2ZBH	0.71
FRR	(3R,5Z,8S,9S,11E)-8,9,16-TRIHYDROXY-14-METHOXY-3-METHYL-3,4,9,10-TETRAHYDRO-1H-2-BENZOXACYCLOTETRADECINE-1,7(8H)-DIONE	A	2E14	0.73
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.75
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.75
U01	3-[1-(4-BROMO-PHENYL)-2-METHYL-PROPYL]-4-HYDROXY-CHROMEN-2-ONE	A	1UPJ	0.74
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.78
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.78
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.78
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.78
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.78
FIL	(1E)-1-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]ETHANONE O-(AMINOCARBONYL)OXIME	A,B	1XLZ	0.75
5PP	5-PENTYL-2-PHENOXYPHENOL	A,B,C,D,E,F	2B36	0.83
MUG	4-METHYLUMBELLIFERYL-ALPHA-D-GLUCOSE	A,B,C,D	1CJP	0.72
8CM	8-HYDROXYCOUMARIN	A	2H8Z	0.8
MYF	5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O65	0.71
DBA	(2,6-DIMETHYL-PHENOXY)-ACETIC ACID	A,B	1IDB	0.8
DHC	CAFFEIC ACID	A,B,C,D,E,F,G,H	2O7D	0.73
DHC	CAFFEIC ACID	A	1KOU	0.73
ZHZ	2-(4-METHOXYPHENYL)ACETAMIDE	D,H	2HKR	0.74
E3G	ESTRONE BETA-D-GLUCURONIDE	H,L	1CFV	0.7
MPP	3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID	A,B	2AY3	0.95
C61	(2R,4S,5S,7S)-5-AMINO-N-BUTYL-4-HYDROXY-7-[4-METHOXY-3-(3-METHOXYPROPOXY)BENZYL]-2,8-DIMETHYLNONANAMIDE	C,O	2V10	0.73
CIO	CILOMILAST	A,B	1XOM	0.86
CIO	CILOMILAST	A,B	1XLX	0.86
FX3	5-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-alpha-L-ribofuranose	A	2VGD	0.76
8PS	5-OCTYL-2-PHENOXYPHENOL	A,B,C,D,E,F	2B37	0.83
EPT	HEPTANYL-P-PHENOL	A,B	1AHZ	0.7
VII	2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID	A,B	2GFK	0.72
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	M,N,O,P,Q,R	3PCN	0.78
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	B	1AI4	0.78
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B,C,D	1Q0C	0.78
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B	1F1V	0.78
4FE	(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid	A	3CBG	0.83
DQH	(2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP5	0.71
DQH	(2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	D,F	2C29	0.71
HFL	5-(3,3-DIHYDROXYPROPENY)-3-METHOXY-BENZENE-1,2-DIOL	C,F	1KYW	0.75
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.81
A18	5-(2-CHLOROBENZYL)-2-FUROIC ACID	A	2Q96	0.7
COU	COUMARIN	A	3CRB	0.74
COU	COUMARIN	A	2PMJ	0.74
COU	COUMARIN	A	2H90	0.74
COU	COUMARIN	A,B,C,D	1Z10	0.74
COU	COUMARIN	A	2PWB	0.74
SIG	STIGMATELLIN	C,D,E	2BCC	0.74
SIG	STIGMATELLIN	C,D,E	3BCC	0.74
268	2-phenoxyethanol	A	2RBR	0.71
TDS	8-HYDROXY-5,7-DIMETHOXY-3-METHYL-2-TRIDECYL-4H-CHROMEN-4-ONE	A,B,C,D,L,R	1Q90	0.73
TDS	8-HYDROXY-5,7-DIMETHOXY-3-METHYL-2-TRIDECYL-4H-CHROMEN-4-ONE	A,B,C,D,G	2E76	0.73
TDS	8-HYDROXY-5,7-DIMETHOXY-3-METHYL-2-TRIDECYL-4H-CHROMEN-4-ONE	A,B,C,D,E,N,O,P,Q,R	1VF5	0.73
GRR	(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid	A	3CDS	0.85
SWF	S-WARFARIN	A,B	1OG5	0.78
V55	4-hydroxy-3-methoxybenzaldehyde	B,D,E,F	2VSS	0.78
V55	4-hydroxy-3-methoxybenzaldehyde	A,B,D,E,F	2VSU	0.78
YR3	(2S)-3-{4-[1-ethyl-1-(4-{[(2R)-2-hydroxy-3,3-dimethylbutyl]oxy}-3-methylphenyl)propyl]-2-methylphenoxy}propane-1,2-diol	A	2ZFX	0.77
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.84
POD	9-HYDROXY-5-(3,4,5-TRIMETHOXYPHENYL)-5,8,8A,9-TETRAHYDROFURO[3',4':6,7]NAPHTHO[2,3-D][1,3]DIOXOL-6(5AH)-ONE	A,B,C,D	1SA1	0.74
3A3		A	2CGU	0.73
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	H,I	1A2C	0.76
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C	1CA7	0.76
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C,D	3GGO	0.76
SXX	SINAPINATE	A,B	1WB4	0.79
Y12	4-{(1E)-3-OXO-3-[(2-PHENYLETHYL)AMINO]PROP-1-EN-1-YL}-1,2-PHENYLENE DIACETATE	A	2EW5	0.72
DR6	ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]-OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL)	C,I,T	1YTZ	0.78
T33	3,3'-DEIODO-THYROXINE	A,B	1THA	0.72
TXF	(Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}-5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL	A,B,C,D,E	2EWP	0.7
8MO	METHOXSALEN	A,B,C,D	1Z11	0.72
DFL	2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1JEP	0.72
U03	4-HYDROXY-7-METHOXY-3-(1-PHENYL-PROPYL)-CHROMEN-2-ONE	A	3UPJ	0.79
OXN	OXTOXYNOL-10	A	1IKT	0.79
OXN	OXTOXYNOL-10	A,B	2Q32	0.79
OXN	OXTOXYNOL-10	A,B	1UEH	0.79
OXN	OXTOXYNOL-10	A,B	2D4Q	0.79
3HB	3-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCB	0.71
3HB	3-HYDROXYBENZOIC ACID	A	2DKH	0.71
EUG	2-METHOXY-4-VINYL-PHENOL	A	2QU9	0.8
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1QLU	0.8
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1J	0.8
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	2VAO	0.8
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1K	0.8
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1DZN	0.8
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1L	0.8
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1M	0.8
FDS	FLUORESCIN	H	4FAB	0.72
SYR	SYRINGATE	A,B	1WB5	0.78
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	L	1FLR	0.73
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A,B	1N0S	0.73
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	C,L	1T66	0.73
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A	1X9Q	0.73
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A,D	2NMV	0.73
IH5	[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-3,5-DIMETHYLPHENYL]ACETIC ACID	A	1NAV	0.75
IH5	[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-3,5-DIMETHYLPHENYL]ACETIC ACID	A	1NAX	0.75
BYS	2-BENZO[1,3]DIOXOL-5-YLMETHYL-3-BENZYL-SUCCINIC ACID	A,B	1JJE	0.83
ODE	DIETHYL (1R,2S,3R,4S)-5,6-BIS(4-HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT-5-ENE-2,3-DICARBOXYLATE	A,B	2QH6	0.73
300	2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE	A	1O41	0.75
EGT	2-(3,4,5-TRIHYDROXY-PHENYL)-CHROMAN-3,5,7-TRIOL	A	1JNQ	0.72
HMY	(1aR,8S,13S,14S,15aR)-5,13,14-trihydroxy-3-methoxy-8-methyl-8,9,13,14,15,15a-hexahydro-6H-oxireno[k][2]benzoxacyclotetradecine-6,12(1aH)-dione	A,B	3C9W	0.71
NOA	NAPHTHYLOXYACETIC ACID	A,B,I	1HIV	0.77
NOA	NAPHTHYLOXYACETIC ACID	I	1IVP	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BV0	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B,D,F,H,J,L	1YKP	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1N8Q	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B	2BSL	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKL	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D	1B4U	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	A	3DX5	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCA	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKN	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	B	1EOB	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1PHH	0.71
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BUV	0.71
MCT	4-METHYLCATECHOL	A	1L4G	0.7
MCT	4-METHYLCATECHOL	A	2EHZ	0.7
MCT	4-METHYLCATECHOL	A,B	1DMH	0.7
TON	2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL	A,B	1SEZ	0.8
ZZ1	4-METHYL-2H-CHROMEN-2-ONE	A	2CIP	0.78
TY3	3-HYDROXY-L-TYROSINE	A,B	2VH3	0.7
HOM	7-HYDROXY-4-METHYL-3-(2-HYDROXY-ETHYL)COUMARIN	C,D	1CJF	0.76
SDT	3,4-dihydroxy-9,10-secoandrosta-1(10),2,4-triene-9,17-dione	A,B	2ZI8	0.71
HHH	(2S)-hydroxy(4-hydroxyphenyl)ethanoic acid	A,B	2R5V	0.74
VNL	4-HYDROXY-3-METHOXYBENZOATE	A,B,C,D	2AHC	0.81
VNL	4-HYDROXY-3-METHOXYBENZOATE	A	1XLR	0.81
UQ6	5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA-2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY-6-METHYL-BENZENE-1,4-DIOL	C,D,E	1EZV	0.71
UQ6	5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA-2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY-6-METHYL-BENZENE-1,4-DIOL	A,C,D,E	1P84	0.71
UQ6	5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA-2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY-6-METHYL-BENZENE-1,4-DIOL	C,D,E	2IBZ	0.71
UQ6	5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA-2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY-6-METHYL-BENZENE-1,4-DIOL	A,C,D,E	1KB9	0.71
IM3	(2E)-3-(3,4-DIHYDROXYPHENYL)-2-IMINOPROPANOIC ACID	A,B,C,D	2E82	0.74
HZ3	dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate	A,B	2QR9	0.74
296	(3R)-3-amino-2,2-difluoro-3-(4-methoxyphenyl)propanoic acid	A,B	2RJS	0.72
FSE	3,7,3',4'-TETRAHYDROXYFLAVONE	B	1XO2	0.7
KOM	7,8-dihydroxy-4-phenyl-2H-chromen-2-one	A	2ZVJ	0.78
2C2	(2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID	A	2IME	0.78
2C2	(2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID	A	2IMD	0.78
4MU	7-hydroxy-4-methyl-2H-chromen-2-one	A,B	3ETS	0.75
YZ9	7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER	A,B,C	1GCZ	0.74
3HP	3-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCE	0.75
FLT	FLUOROMALONYL TYROSINE	I	1BZH	0.74
VXX	VANILLATE	A,B	1WB6	0.82
4TN	(2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)-4-HYDROXYPHENYL]ACRYLIC ACID	A	2P1U	0.76
HXP	3,6-DIHYDROXY-XANTHENE-9-PROPIONIC ACID	A	1XAN	0.77
A04	5-[2-(TRIFLUOROMETHOXY)PHENYL]-2-FUROIC ACID	A	2Q94	0.72
EGC	2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3-TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL	A,B	1JP3	0.79
EGC	2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3-TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL	A	2W22	0.79
YRG	(2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid	A	3CDP	0.77
DBF	DIBENZOFURAN-4,6-DICARBOXYLIC ACID	B	1DVU	0.7
TRT	FRAGMENT OF TRITON X-100	A,E	2I0U	0.8
TRT	FRAGMENT OF TRITON X-100	A,B	1OIZ	0.8
B21	5-(2-METHOXYPHENYL)-2-FUROIC ACID	A	2Q93	0.76
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A,B	1I7I	0.82
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A	1I7G	0.82
SAK	(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-4H-chromen-4-one	A,B,C,D,E,F	3D04	0.7
H53	2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL	A	2FF5	0.71
H53	2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL	A	2FET	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	X	1Y0X	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A	1HK1	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	C,D	1ICT	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A	2RIW	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A,B	2ROX	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A,B	1IE4	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	1,2	1ETB	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	1,2	1ETA	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A,B,C	1SN0	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A,B	2CEO	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A,B	1F86	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A	1HK4	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A	1HK2	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A	1HK5	0.71
T44	3,5,3',5'-TETRAIODO-L-THYRONINE	A	1HK3	0.71
BDS	2,3-BIS-BENZO[1,3]DIOXOL-5-YLMETHYL-SUCCINIC ACID	A,B	1JJT	0.81
ERD	(2S)-2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	D,F	2NNL	0.72
MGI	methyl 4-(2,3-dihydroxy-5-methylphenoxy)-2-hydroxy-6-methylbenzoate	A	2ZA0	0.78
CA2	(1S,3R,4R,5S)-1,3,4-TRIHYDROXY-5-(3-PHENOXYPROPYL)CYCLOHEXANECARBOXYLIC ACID	A,B,C,D,E,F,G,H,I,J,K,L	2BT4	0.78
SMA	STIGMATELLIN A	A,C,D,E,N,P,Q,R	3H1I	0.74
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,O,P,Q,R,S,T	1PPJ	0.74
SMA	STIGMATELLIN A	A,C,D,E,L,N,O,P,W	3CXH	0.74
SMA	STIGMATELLIN A	C,D,E,P,Q,R	1ZRT	0.74
SMA	STIGMATELLIN A	C,H,L,M	2JBL	0.74
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,I,N,O,P,Q,R,S,T,U,V,W	2A06	0.74
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L	2QJP	0.74
SMA	STIGMATELLIN A	A,C,D,E	1KB9	0.74
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2QJK	0.74
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,N,O,P,Q,R,S,T	1PP9	0.74
SMA	STIGMATELLIN A	C,D,E	2IBZ	0.74
SMA	STIGMATELLIN A	A,C,D,E,L,N,O,P,W	3CX5	0.74
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2FYN	0.74
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2QJY	0.74
SMA	STIGMATELLIN A	C,D,E	1EZV	0.74
SMA	STIGMATELLIN A	C,D,E,N,O,P,W	1KYO	0.74
SMA	STIGMATELLIN A	A,C,D,E,G,N,P,Q,R,S	3H1J	0.74
SMA	STIGMATELLIN A	C,D,E	1SQX	0.74
BRZ	6-(1,1-DIMETHYLALLYL)-2-(1-HYDROXY-1-METHYLETHYL)-2,3-DIHYDRO-7H-FURO[3,2-G]CHROMEN-7-ONE	C	1K3T	0.76
OEF	3,5-DIBROMO-4-(3-ISOPROPYL-PHENOXY)BENZOIC ACID	A	2J4A	0.77
G24	[4-(3-BENZYL-4-HYDROXYBENZYL)-3,5-DIMETHYLPHENOXY]ACETIC ACID	A	1Q4X	0.79
OHP	(2-HYDROXYPHENYL)ACETIC ACID	A	2INZ	0.74
FLN	2-PHENYL-4H-CHROMEN-4-ONE	A	2G0L	0.71