Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02365468

Ligand	Ligand name	Chain	PDB	Tanimoto
4HC	4-HYDROXY-2H-CHROMEN-2-ONE	A,B	1V5Y	0.71
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B	2TPL	0.72
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B,C,D	3GGP	0.72
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	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	0.74
NRO	3-[5-(2-nitropent-1-en-1-yl)furan-2-yl]benzoic acid	A,B	2ZK5	0.72
HIB	4-HYDROXY-5-IODO-2,3-DIMETHOXY-6-METHYLBENZOIC ACID	A	2PIK	0.73
G24	[4-(3-BENZYL-4-HYDROXYBENZYL)-3,5-DIMETHYLPHENOXY]ACETIC ACID	A	1Q4X	0.73
MOA	MYCOPHENOLIC ACID	A	1ME7	0.74
MOA	MYCOPHENOLIC ACID	A,B	1JR1	0.74
MOA	MYCOPHENOLIC ACID	A	1MEI	0.74
MOA	MYCOPHENOLIC ACID	A	1MEH	0.74
SWF	S-WARFARIN	A,B	1OG5	0.71
AC6	P-HYDROXYACETOPHENONE	A	2GQ8	0.75
AC6	P-HYDROXYACETOPHENONE	X	2O48	0.75
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BV0	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B,D,F,H,J,L	1YKP	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1N8Q	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B	2BSL	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKL	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D	1B4U	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	A	3DX5	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCA	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKN	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	B	1EOB	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1PHH	0.77
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BUV	0.77
V55	4-hydroxy-3-methoxybenzaldehyde	B,D,E,F	2VSS	0.81
V55	4-hydroxy-3-methoxybenzaldehyde	A,B,D,E,F	2VSU	0.81
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.83
FOA	2-FUROIC ACID	A,B	2GF3	0.74
FOA	2-FUROIC ACID	A,B,D	2GAG	0.74
FOA	2-FUROIC ACID	A,B,C,D	2GAH	0.74
RUT	RUTIN	A,B	1RY8	0.71
7CA	5,7-DIHYDROXY-2-(4-METHOXYPHENYL)-8-(3-METHYLBUTYL)-4-OXO-4H-CHROMEN-3-YL 6-DEOXY-ALPHA-L-MANNOPYRANOSIDE	A	2H44	0.73
113	7,8-DIHYDROXY-1-METHOXY-3-METHYL-10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3-B]CHROMENE-9-CARBOXYLIC ACID	A,B	1KR3	0.7
113	7,8-DIHYDROXY-1-METHOXY-3-METHYL-10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3-B]CHROMENE-9-CARBOXYLIC ACID	A,B	1HLK	0.7
TOH	(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IME	0.72
TOH	(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IMD	0.72
HHH	(2S)-hydroxy(4-hydroxyphenyl)ethanoic acid	A,B	2R5V	0.79
DFL	2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1JEP	0.76
8MO	METHOXSALEN	A,B,C,D	1Z11	0.76
B21	5-(2-METHOXYPHENYL)-2-FUROIC ACID	A	2Q93	0.84
A18	5-(2-CHLOROBENZYL)-2-FUROIC ACID	A	2Q96	0.79
HC4		A	1TS6	0.7
HC4		A	3PHY	0.7
HC4		A	3PYP	0.7
HC4		A	1T1C	0.7
HC4		A	1OT6	0.7
HC4		A	1TS0	0.7
HC4		A	1T1A	0.7
HC4		A	2PYP	0.7
HC4		A	2ZOI	0.7
HC4		A	1OTI	0.7
HC4		A	1XFQ	0.7
HC4		A	2D01	0.7
HC4		A,B,C,D,E,F,G,H	2O7B	0.7
HC4		A	2ZOH	0.7
HC4		A	1GSW	0.7
HC4		A	2QJ7	0.7
HC4		A	1F9I	0.7
HC4		X	1UWP	0.7
HC4		A	2PHY	0.7
HC4		A	1T1B	0.7
HC4		A	1F98	0.7
HC4		A	1T19	0.7
HC4		X	1UWN	0.7
HC4		A,B,C,D,E,F,G,H	2O7F	0.7
HC4		A	1UGU	0.7
HC4		A	1TS8	0.7
HC4		A,B	1OTD	0.7
HC4		A	1OTE	0.7
HC4		A	1GSX	0.7
HC4		A	1TS7	0.7
HC4		A	2PYR	0.7
HC4		A	1S4S	0.7
HC4		A	1GSV	0.7
HC4		A	2I9V	0.7
HC4		A	2QWS	0.7
HC4		A	1XFN	0.7
HC4		A	1S4R	0.7
HC4		A	1T18	0.7
HC4		A	1OTA	0.7
HC4		A	1D7E	0.7
HC4		A	1S1Z	0.7
HC4		A,B,C	1MZU	0.7
HC4		A,B	1ODV	0.7
HC4		A,B	2J3J	0.7
HC4		A	2QJ5	0.7
HC4		A	1OTB	0.7
HC4		A	2D02	0.7
HC4		A	1OT9	0.7
HC4		A	1NWZ	0.7
HC4		A	1S1Y	0.7
YZ9	7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER	A,B,C	1GCZ	0.76
QSO	5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one	A,B	2QYO	0.76
FHB	3-FLUORO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCF	0.77
FLN	2-PHENYL-4H-CHROMEN-4-ONE	A	2G0L	0.73
34D	3,5-DIHYDROXYBENZOATE	A,B	2BX7	0.72
GRR	(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid	A	3CDS	0.83
SMN	(S)-MANDELIC ACID	A	1MDL	0.7
OAC	TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE	C	3GCH	0.73
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	M,N,O,P,Q,R	3PCN	0.75
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	B	1AI4	0.75
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B,C,D	1Q0C	0.75
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B	1F1V	0.75
CHB	3-CHLORO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCH	0.71
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	B,C	1JX1	0.76
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1JX0	0.76
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1FM7	0.76
HZ3	dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate	A,B	2QR9	0.71
TRT	FRAGMENT OF TRITON X-100	A,E	2I0U	0.7
TRT	FRAGMENT OF TRITON X-100	A,B	1OIZ	0.7
NOM	7-HYDROXY-5-METHYL-3,3A,5,11B-TETRAHYDRO-1,4-DIOXA-CYCLOPENTA[A]ANTHRACENE-2,6,11-TRIONE	A	1N5V	0.71
8CM	8-HYDROXYCOUMARIN	A	2H8Z	0.71
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1DOD	0.75
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1DOE	0.75
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1PBB	0.75
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
ORE	4-(2,7-DIFLUORO-6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)ISOPHTHALIC ACID	H,I	2A9N	0.71
KMP	3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE	A,B,C,D	1H1M	0.76
KMP	3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2C1Z	0.76
SXX	SINAPINATE	A,B	1WB4	0.78
HBA	P-HYDROXYBENZALDEHYDE	A	1K03	0.75
HBA	P-HYDROXYBENZALDEHYDE	A,B	2VQ5	0.75
HBA	P-HYDROXYBENZALDEHYDE	A,B	1EB9	0.75
HBA	P-HYDROXYBENZALDEHYDE	A	2GQ9	0.75
HBA	P-HYDROXYBENZALDEHYDE	A,B	1Z42	0.75
HBA	P-HYDROXYBENZALDEHYDE	A	1OYB	0.75
A04	5-[2-(TRIFLUOROMETHOXY)PHENYL]-2-FUROIC ACID	A	2Q94	0.79
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.91
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.91
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.91
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.91
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.91
GRE	2,6-DIHYDROXYBENZOIC ACID	A,B,C,D	2DVU	0.72
EAA	ETHACRYNIC ACID	A,B	3DGQ	0.81
EAA	ETHACRYNIC ACID	A,B	11GS	0.81
EAA	ETHACRYNIC ACID	A,B,C,D	1GSF	0.81
EAA	ETHACRYNIC ACID	A,B	2GSS	0.81
EAA	ETHACRYNIC ACID	A,B	3GSS	0.81
EAA	ETHACRYNIC ACID	A,B	1GSE	0.81
IHB	3-IODO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCI	0.77
TON	2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL	A,B	1SEZ	0.72
667	6-OXO-8,9,10,11-TETRAHYDRO-7H-CYCLOHEPTA[C][1]BENZOPYRAN-3-O-SULFAMATE	A	1TTM	0.72
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A	2Z9C	0.74
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A,B	1OOQ	0.74
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A,B,C,D,E,F,G,H	2F1O	0.74
S1A	SORAPHEN A	A,B	3GID	0.7
S1A	SORAPHEN A	A,B,C	1W96	0.7
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	H,I	1A2C	0.75
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C	1CA7	0.75
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C,D	3GGO	0.75
YRG	(2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid	A	3CDP	0.76
VNL	4-HYDROXY-3-METHOXYBENZOATE	A,B,C,D	2AHC	0.86
VNL	4-HYDROXY-3-METHOXYBENZOATE	A	1XLR	0.86
NCZ	2-HYDROXY-7-METHOXY-5-METHYL-NAPHTHALENE-1-CARBOXYLIC ACID MESO-2,5-DIHYDROXY-CYCLOPENT-3-ENYL ESTER	A	1J5I	0.77
HMO	4'-HYDROXY-7-METHOXYISOFLAVONE	A	1FP2	0.76
HXP	3,6-DIHYDROXY-XANTHENE-9-PROPIONIC ACID	A	1XAN	0.71
PHB	P-HYDROXYBENZOIC ACID	A	1CJ4	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1DOB	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1PXB	0.79
PHB	P-HYDROXYBENZOIC ACID	A,B	1G1B	0.79
PHB	P-HYDROXYBENZOIC ACID	A,B	1YKJ	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1IUV	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1PBE	0.79
PHB	P-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCC	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1PDH	0.79
PHB	P-HYDROXYBENZOIC ACID	B	2BUW	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1CC4	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1CC6	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1IUW	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1FW9	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1G81	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1BGJ	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1IUX	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1CJ3	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1D7L	0.79
PHB	P-HYDROXYBENZOIC ACID	A	2PHH	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1BGN	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1PXA	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1DOC	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1K0I	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1BKW	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1JD3	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1PXC	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1TT8	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1CJ2	0.79
PHB	P-HYDROXYBENZOIC ACID	A,B	1Q4S	0.79
PHB	P-HYDROXYBENZOIC ACID	A	1BF3	0.79
PHB	P-HYDROXYBENZOIC ACID	B	2BUR	0.79
SDN	[(3S)-9-hydroxy-1-methyl-10-oxo-4,10-dihydro-3H-benzo[g]isochromen-3-yl]acetic acid	A,B	3B6C	0.71
MUG	4-METHYLUMBELLIFERYL-ALPHA-D-GLUCOSE	A,B,C,D	1CJP	0.72
GEN	GENISTEIN	A	1QKM	0.76
GEN	GENISTEIN	A,B	1X7J	0.76
GEN	GENISTEIN	A,B	2QA8	0.76
GEN	GENISTEIN	A	1X7R	0.76
DBA	(2,6-DIMETHYL-PHENOXY)-ACETIC ACID	A,B	1IDB	0.8
L1O	4-(2-aminoethoxy)-3,5-dichlorobenzoic acid	A	2VIO	0.72
FCD	5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACID	A	1XNZ	0.77
OMD	2-(3,6-DIHYDROXYPHENYL)ACETIC ACID	A,B	1AJP	0.72
3HB	3-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCB	0.73
3HB	3-HYDROXYBENZOIC ACID	A	2DKH	0.73
4HP	4-HYDROXYPHENYLACETATE	A,B,C,D	2JBT	0.73
4HP	4-HYDROXYPHENYLACETATE	A	2YYJ	0.73
4HP	4-HYDROXYPHENYLACETATE	A	2YYM	0.73
4HP	4-HYDROXYPHENYLACETATE	B	1AI6	0.73
4HP	4-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCG	0.73
HOM	7-HYDROXY-4-METHYL-3-(2-HYDROXY-ETHYL)COUMARIN	C,D	1CJF	0.75
REF	2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione	A	2ZJW	0.72
HCC	2',4,4'-TRIHYDROXYCHALCONE	D	1FP1	0.71
U03	4-HYDROXY-7-METHOXY-3-(1-PHENYL-PROPYL)-CHROMEN-2-ONE	A	3UPJ	0.74
300	2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE	A	1O41	0.76
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	L	1FLR	0.74
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A,B	1N0S	0.74
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	C,L	1T66	0.74
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A	1X9Q	0.74
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A,D	2NMV	0.74
ZZ1	4-METHYL-2H-CHROMEN-2-ONE	A	2CIP	0.72
397	2-(4-HYDROXY-PHENYL)BENZOFURAN-5-OL	A,B	1U9E	0.72
3MB	3-METHOXYBENZAMIDE	A	3PAX	0.72
FSE	3,7,3',4'-TETRAHYDROXYFLAVONE	B	1XO2	0.75
OXN	OXTOXYNOL-10	A	1IKT	0.71
OXN	OXTOXYNOL-10	A,B	2Q32	0.71
OXN	OXTOXYNOL-10	A,B	1UEH	0.71
OXN	OXTOXYNOL-10	A,B	2D4Q	0.71
OHP	(2-HYDROXYPHENYL)ACETIC ACID	A	2INZ	0.7
MYC	3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A,B,C,D	3C1T	0.73
MYC	3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O63	0.73
MYC	3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	1E90	0.73
MYC	3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A,B,C,D	2IOD	0.73
FX3	5-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-alpha-L-ribofuranose	A	2VGD	0.74
FC2	5-(2,5-DICHLOROPHENYL)-2-FUROIC ACID	A	2EVM	0.76
ZHZ	2-(4-METHOXYPHENYL)ACETAMIDE	D,H	2HKR	0.71
4FE	(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid	A	3CBG	0.78
DZN	DAIDZIN	A,B,C,D,E,F,G,H	2VLE	0.72
ERD	(2S)-2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	D,F	2NNL	0.73
DR6	ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]-OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL)	C,I,T	1YTZ	0.7
2HI	(2S,3R)-2,7-DIHYDROXY-3-(4-HYDROXYPHENYL)-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1ZG3	0.73
FLT	FLUOROMALONYL TYROSINE	I	1BZH	0.72
FC3	5-[2-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID	A	2EVC	0.8
SAK	(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-4H-chromen-4-one	A,B,C,D,E,F	3D04	0.75
SAL	2-HYDROXYBENZOIC ACID	A	2I2Z	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B,C	1FIQ	0.71
SAL	2-HYDROXYBENZOIC ACID	A	2I30	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B	1PTH	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B	3DEU	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B,C,D	2E1Q	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B	3HGX	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B	3BPX	0.71
SAL	2-HYDROXYBENZOIC ACID	A	1WYG	0.71
SAL	2-HYDROXYBENZOIC ACID	A	1JGS	0.71
SAL	2-HYDROXYBENZOIC ACID	X	1M6E	0.71
SAL	2-HYDROXYBENZOIC ACID	A	3B9M	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B	1FO4	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B	1Y7I	0.71
SAL	2-HYDROXYBENZOIC ACID	A,B	2FN1	0.71
L41	{4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid	A,B	3D5F	0.83
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,C,E	1KYZ	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1JT2	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	6ATJ	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B	1GKL	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1GWT	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B,C	2BJH	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1GW2	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	3CBG	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	2BNJ	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B	1UWC	0.78
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	7ATJ	0.78
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A,B	1I7I	0.79
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A	1I7G	0.79
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.87
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.87
VXX	VANILLATE	A,B	1WB6	0.88
DQH	(2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP5	0.75
DQH	(2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	D,F	2C29	0.75
HFL	5-(3,3-DIHYDROXYPROPENY)-3-METHOXY-BENZENE-1,2-DIOL	C,F	1KYW	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PIT	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ1	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PIU	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PKL	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A,B	3D57	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ2	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2QPY	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ0	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NUO	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A,B	2PIN	0.74
34C	(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID	A,B	1HT8	0.74
OFF	2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]-L-THREO-PENTARIC ACID	A	2OFF	0.77
AGI	5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one	A,B,C,D,E,F	3CF9	0.75
COU	COUMARIN	A	3CRB	0.72
COU	COUMARIN	A	2PMJ	0.72
COU	COUMARIN	A	2H90	0.72
COU	COUMARIN	A,B,C,D	1Z10	0.72
COU	COUMARIN	A	2PWB	0.72
RWF	R-WARFARIN	A,B	2BXD	0.71
G50	3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN-1-ONE	A,B	2UXI	0.7
DDC	7-HYDROXY-2-PHENYL-CHROMAN-4-ONE	A,B	1FM8	0.75
PFI	(6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO-4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY-5,6-DIHYDRO-2H-PYRAN-2-ONE	A	2HAI	0.71
4MU	7-hydroxy-4-methyl-2H-chromen-2-one	A,B	3ETS	0.73
SIG	STIGMATELLIN	C,D,E	2BCC	0.72
SIG	STIGMATELLIN	C,D,E	3BCC	0.72
MGI	methyl 4-(2,3-dihydroxy-5-methylphenoxy)-2-hydroxy-6-methylbenzoate	A	2ZA0	0.77
SMA	STIGMATELLIN A	A,C,D,E,N,P,Q,R	3H1I	0.73
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,O,P,Q,R,S,T	1PPJ	0.73
SMA	STIGMATELLIN A	A,C,D,E,L,N,O,P,W	3CXH	0.73
SMA	STIGMATELLIN A	C,D,E,P,Q,R	1ZRT	0.73
SMA	STIGMATELLIN A	C,H,L,M	2JBL	0.73
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,I,N,O,P,Q,R,S,T,U,V,W	2A06	0.73
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L	2QJP	0.73
SMA	STIGMATELLIN A	A,C,D,E	1KB9	0.73
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2QJK	0.73
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,N,O,P,Q,R,S,T	1PP9	0.73
SMA	STIGMATELLIN A	C,D,E	2IBZ	0.73
SMA	STIGMATELLIN A	A,C,D,E,L,N,O,P,W	3CX5	0.73
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2FYN	0.73
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2QJY	0.73
SMA	STIGMATELLIN A	C,D,E	1EZV	0.73
SMA	STIGMATELLIN A	C,D,E,N,O,P,W	1KYO	0.73
SMA	STIGMATELLIN A	A,C,D,E,G,N,P,Q,R,S	3H1J	0.73
SMA	STIGMATELLIN A	C,D,E	1SQX	0.73
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3B3K	0.78
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3D6D	0.78
SN1	2,4-DIHYDROXY-TRANS CINNAMIC ACID	1	1K2I	0.7
SYR	SYRINGATE	A,B	1WB5	0.84
DH2	(2S,3S)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP5	0.75
DH2	(2S,3S)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP6	0.75
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2QZZ	0.77
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2R2G	0.77
MYF	5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O65	0.72
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.7
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	0.83
694	4-BROMO-3-(CARBOXYMETHOXY)-5-(4-HYDROXYPHENYL)THIOPHENE-2-CARBOXYLIC ACID	A	2H4G	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	0.77
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F	3BXX	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	2O3P	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B	2UXH	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	1GP6	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	2C9Z	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F,G,H,I,J,K,L,M,N	2JJ2	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	3BPT	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F	3CF8	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B	2HCK	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D	1H1I	0.74
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	1E8W	0.74
BZF	BENZOFURAN	A	182L	0.73
WRR	4-HYDROXY-3-[(1S,3R)-3-HYDROXY-1-PHENYLBUTYL]-2H-CHROMEN-2-ONE	A	1H9Z	0.76
FDS	FLUORESCIN	H	4FAB	0.74
T4A		C,D	1KGI	0.73
T4A		A,B	1Z7J	0.73
TDS	8-HYDROXY-5,7-DIMETHOXY-3-METHYL-2-TRIDECYL-4H-CHROMEN-4-ONE	A,B,C,D,L,R	1Q90	0.72
TDS	8-HYDROXY-5,7-DIMETHOXY-3-METHYL-2-TRIDECYL-4H-CHROMEN-4-ONE	A,B,C,D,G	2E76	0.72
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	0.72
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	0.8
2C2	(2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID	A	2IME	0.77
2C2	(2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID	A	2IMD	0.77
3HP	3-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCE	0.74
MAX	MATAIRESINOL	A	2BGM	0.75
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A,B	1FHY	0.72
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	B	204D	0.72
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A,B	2B2B	0.72
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	B	1FHZ	0.72
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A	203D	0.72
MYU	3,5,6,7-TETRAHYDROXY-2-(3,4-DIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O64	0.73
E3G	ESTRONE BETA-D-GLUCURONIDE	H,L	1CFV	0.71
DBE	bis(4-hydroxyphenyl)methanone	A	2VKU	0.73
EUG	2-METHOXY-4-VINYL-PHENOL	A	2QU9	0.71
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1QLU	0.71
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1J	0.71
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	2VAO	0.71
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1K	0.71
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1DZN	0.71
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1L	0.71
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1M	0.71
C17	7-[(3-CHLOROBENZYL)OXY]-2-OXO-2H-CHROMENE-4-CARBALDEHYDE	A,B	2V60	0.71
NOA	NAPHTHYLOXYACETIC ACID	A,B,I	1HIV	0.74
NOA	NAPHTHYLOXYACETIC ACID	I	1IVP	0.74
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
FUX	5-HYDROXYMETHYL-FURFURAL	A,B,C,D	1QXE	0.74
CIO	CILOMILAST	A,B	1XOM	0.71
CIO	CILOMILAST	A,B	1XLX	0.71
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	0.71
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	0.71
RMN	(R)-MANDELIC ACID	A	1MDL	0.7
RMN	(R)-MANDELIC ACID	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	1MCZ	0.7
WRS	4-HYDROXY-3-[(1S,3S)-3-HYDROXY-1-PHENYLBUTYL]-2H-CHROMEN-2-ONE	A	1HA2	0.76
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.7
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.7
STG	ESTRIOL 3-(B-D-GLUCURONIDE)	H	2BFV	0.7
STG	ESTRIOL 3-(B-D-GLUCURONIDE)	H,L	1BFV	0.7
TOM	4-(2-METHOXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IMF	0.82
NAR	NARINGENIN	A,B	2UXU	0.75
NAR	NARINGENIN	A	2BRT	0.75
NAR	NARINGENIN	A	1CGK	0.75
NAR	NARINGENIN	A,B	1EYQ	0.75
MPP	3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID	A,B	2AY3	0.81