Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00002579

Ligand	Ligand name	Chain	PDB	Tanimoto
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D	3E5U	0.72
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	A,B	3E6B	0.72
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D	3E5X	0.72
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	A,B	2H6B	0.72
3C4	(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID	C	3E6C	0.72
RMN	(R)-MANDELIC ACID	A	1MDL	0.82
RMN	(R)-MANDELIC ACID	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	1MCZ	0.82
PG9	D-PHENYLGLYCINE	A,B,G,H	10GS	0.7
PG9	D-PHENYLGLYCINE	A,B,C,D	2B4K	0.7
23A	2,3-DIHYDROXYBENZALDEHYDE	A,B,C,D	2DVX	0.74
DHC	CAFFEIC ACID	A,B,C,D,E,F,G,H	2O7D	0.72
DHC	CAFFEIC ACID	A	1KOU	0.72
SS1	1-PHENYLETHANOL	H	1UM5	0.72
BTP	2-THIOMETHYL-3-PHENYLPROPANOIC ACID	A,B	1JAO	0.75
OSB	2-SUCCINYLBENZOATE	A	1FHV	0.88
OSB	2-SUCCINYLBENZOATE	A,B,C,D	1SJB	0.88
OSB	2-SUCCINYLBENZOATE	A,B	2QVH	0.88
CVB	4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID	A,B	1KE0	0.77
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5A	0.71
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5C	0.71
BHC	BENZENE HEXACARBOXYLIC ACID	A,B,C,D	1BQ4	0.75
UIN	5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN-2-ONE	B	5UPJ	0.73
TOH	(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IME	0.77
TOH	(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IMD	0.77
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	H,I	1A2C	0.78
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C	1CA7	0.78
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C,D	3GGO	0.78
341	(3,5-difluorophenyl)methanol	C	3EON	0.73
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.8
BGG	CARBONIC ACID MONOBENZYL ESTER	B,D	1DLK	0.73
791	2-PHENYLMALONIC ACID	A	1O4P	0.78
C0E	3-fluoro-6-(4-fluorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid	A	2RHW	0.76
HC4		A	1TS6	0.78
HC4		A	3PHY	0.78
HC4		A	3PYP	0.78
HC4		A	1T1C	0.78
HC4		A	1OT6	0.78
HC4		A	1TS0	0.78
HC4		A	1T1A	0.78
HC4		A	2PYP	0.78
HC4		A	2ZOI	0.78
HC4		A	1OTI	0.78
HC4		A	1XFQ	0.78
HC4		A	2D01	0.78
HC4		A,B,C,D,E,F,G,H	2O7B	0.78
HC4		A	2ZOH	0.78
HC4		A	1GSW	0.78
HC4		A	2QJ7	0.78
HC4		A	1F9I	0.78
HC4		X	1UWP	0.78
HC4		A	2PHY	0.78
HC4		A	1T1B	0.78
HC4		A	1F98	0.78
HC4		A	1T19	0.78
HC4		X	1UWN	0.78
HC4		A,B,C,D,E,F,G,H	2O7F	0.78
HC4		A	1UGU	0.78
HC4		A	1TS8	0.78
HC4		A,B	1OTD	0.78
HC4		A	1OTE	0.78
HC4		A	1GSX	0.78
HC4		A	1TS7	0.78
HC4		A	2PYR	0.78
HC4		A	1S4S	0.78
HC4		A	1GSV	0.78
HC4		A	2I9V	0.78
HC4		A	2QWS	0.78
HC4		A	1XFN	0.78
HC4		A	1S4R	0.78
HC4		A	1T18	0.78
HC4		A	1OTA	0.78
HC4		A	1D7E	0.78
HC4		A	1S1Z	0.78
HC4		A,B,C	1MZU	0.78
HC4		A,B	1ODV	0.78
HC4		A,B	2J3J	0.78
HC4		A	2QJ5	0.78
HC4		A	1OTB	0.78
HC4		A	2D02	0.78
HC4		A	1OT9	0.78
HC4		A	1NWZ	0.78
HC4		A	1S1Y	0.78
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.99
OAC	TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE	C	3GCH	0.75
C2U	3,5-dichloro-2-hydroxybenzoic acid	A	3C3U	0.73
C2U	3,5-dichloro-2-hydroxybenzoic acid	A	3CV7	0.73
MCG	(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE	A,B	1ISS	0.77
4FC		A	1YSG	0.87
24B	(2,4-DIFLUOROPHENYL)METHANOL	A,B	1QV6	0.74
295	(2S,3S)-3-(4-fluorophenyl)-2,3-dihydroxypropanoic acid	A,B	2RJR	0.76
TRZ	TRAZEOLIDE	A	1C12	0.71
OMD	2-(3,6-DIHYDROXYPHENYL)ACETIC ACID	A,B	1AJP	0.74
CHB	3-CHLORO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCH	0.76
FL2	FLURBIPROFEN METHYL ESTER	A,B	1HT5	0.7
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BV0	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B,D,F,H,J,L	1YKP	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1N8Q	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B	2BSL	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKL	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D	1B4U	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	A	3DX5	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCA	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKN	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	B	1EOB	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1PHH	0.78
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BUV	0.78
MN7	1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE	N	1NLO	0.75
AC0	1-PHENYLETHANONE	A	1ZK1	0.72
AC0	1-PHENYLETHANONE	A	1ZK4	0.72
4BA	4-[(2-CARBOXY-ETHYLAMINO)-METHYL]-BENZOIC ACID	C	1FAV	0.75
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F,G,H	1F8S	0.76
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.76
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.76
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.76
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.76
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.76
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.76
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.76
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.76
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.76
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.76
BJP	(1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID	A	1ERO	0.72
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	M,N,O,P,Q,R	3PCN	0.72
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	B	1AI4	0.72
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B,C,D	1Q0C	0.72
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B	1F1V	0.72
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)-2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.73
BZS	L-BENZYLSUCCINIC ACID	A	1CBX	0.76
BZS	L-BENZYLSUCCINIC ACID	A	1HYT	0.76
BZS	L-BENZYLSUCCINIC ACID	A,B	1WHT	0.76
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1F2W	1
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2F14	1
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1BV3	1
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2AW1	1
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1ZE8	1
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.76
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.76
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.76
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.76
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.76
KPV	5-PHENYL-2-KETO-VALERIC ACID	A,B	2Q5Q	0.77
PIC	6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE-2-CARBOXYLIC ACID	A	1BZJ	0.76
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.94
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.94
SCL	ACETIC ACID SALICYLOYL-AMINO-ESTER	A	1EBV	0.71
OHP	(2-HYDROXYPHENYL)ACETIC ACID	A	2INZ	0.8
CP5	(2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}-2-PHENYLACRYLATE	A	1SCW	0.77
184	6-[HYDROXY-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALEN-2-YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCX	0.73
2HC	(2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID	A,B	1V5Z	0.79
ELI	6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN-2-YL)HEXANOIC ACID	A,B	2GH5	0.76
BIP	2-BENZYL-3-IODOPROPANOIC ACID	A,B,C,D	1BAV	0.77
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.94
HPZ	(2E,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA-2,4-DIENOIC ACID	A	2PUJ	0.79
DIC	3,4-DICHLOROISOCOUMARIN	A	1DIC	0.77
BEZ	BENZOIC ACID	A,B	2F8D	1
BEZ	BENZOIC ACID	A,B	1A8U	1
BEZ	BENZOIC ACID	A,B	1REE	1
BEZ	BENZOIC ACID	A	1L7Q	1
BEZ	BENZOIC ACID	A	1I69	1
BEZ	BENZOIC ACID	H,L	1RUL	1
BEZ	BENZOIC ACID	A,B	3CCF	1
BEZ	BENZOIC ACID	A	1W9Q	1
BEZ	BENZOIC ACID	A,B,G,J	2DU8	1
BEZ	BENZOIC ACID	H,L	1RUA	1
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H	1H4O	1
BEZ	BENZOIC ACID	H,L	1RU9	1
BEZ	BENZOIC ACID	A,B,C,D	2V32	1
BEZ	BENZOIC ACID	A	2QMQ	1
BEZ	BENZOIC ACID	A	1UKB	1
BEZ	BENZOIC ACID	A,B	1RED	1
BEZ	BENZOIC ACID	A,B	1OC3	1
BEZ	BENZOIC ACID	A,B	1REF	1
BEZ	BENZOIC ACID	A,B	2O02	1
BEZ	BENZOIC ACID	A,B	2VJ1	1
BEZ	BENZOIC ACID	A,B,C	1WSP	1
BEZ	BENZOIC ACID	A	1HZ4	1
BEZ	BENZOIC ACID	A	2Q38	1
BEZ	BENZOIC ACID	A,B,C,D	1UUJ	1
BEZ	BENZOIC ACID	A,B	2QL8	1
BEZ	BENZOIC ACID	A	2Q0I	1
BEZ	BENZOIC ACID	A,B	1S8F	1
BEZ	BENZOIC ACID	D,E,F,G,H	1DJR	1
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H,I	1ONI	1
BEZ	BENZOIC ACID	A,B,C,D	1I7Q	1
BEZ	BENZOIC ACID	A,B,C,D	2RHM	1
BEZ	BENZOIC ACID	A,B	2F78	1
BEZ	BENZOIC ACID	A,B	2VL2	1
BEZ	BENZOIC ACID	A	1HD2	1
BEZ	BENZOIC ACID	A	1JU4	1
BEZ	BENZOIC ACID	H,L	2AJY	1
BEZ	BENZOIC ACID	A,B,C	3GV1	1
BEZ	BENZOIC ACID	A	2Q6U	1
BEZ	BENZOIC ACID	A,B	1VE9	1
BEZ	BENZOIC ACID	A,B	1S9A	1
BEZ	BENZOIC ACID	H,L,M	1OP3	1
BEZ	BENZOIC ACID	A	1W9E	1
BEZ	BENZOIC ACID	A,B,C,D	2V2G	1
BEZ	BENZOIC ACID	H,L	2AK1	1
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H	2V41	1
BEZ	BENZOIC ACID	A,B	1GYX	1
BEZ	BENZOIC ACID	A	1V1T	1
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H,I,J,K,L	1YAJ	1
BEZ	BENZOIC ACID	A,B	1HKQ	1
BEZ	BENZOIC ACID	H,L	1RUK	1
BEZ	BENZOIC ACID	A	2Q1B	1
BEZ	BENZOIC ACID	H,L	1RUM	1
BEZ	BENZOIC ACID	A,B	2F7A	1
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H	1KIF	1
BEZ	BENZOIC ACID	A,B	2V7B	1
BEZ	BENZOIC ACID	H	1NCW	1
BEZ	BENZOIC ACID	A,B	1TMX	1
BEZ	BENZOIC ACID	A	1URM	1
BEZ	BENZOIC ACID	A	1W9O	1
BEZ	BENZOIC ACID	A,B,C,D	1GXS	1
BEZ	BENZOIC ACID	H	1RUP	1
BEZ	BENZOIC ACID	A,B,C,D	1KQB	1
BEZ	BENZOIC ACID	A	2Q9R	1
BEZ	BENZOIC ACID	D,H	2OK6	1
BEZ	BENZOIC ACID	A,B	2Q0J	1
M5P	(S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID	A,B	2YZ3	0.74
174	4-CHLORO-BENZOIC ACID	X	3DLP	0.89
174	4-CHLORO-BENZOIC ACID	X	1T5D	0.89
564	6-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALENE-2-CARBONYL)-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCY	0.75
SAL	2-HYDROXYBENZOIC ACID	A	2I2Z	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B,C	1FIQ	0.85
SAL	2-HYDROXYBENZOIC ACID	A	2I30	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B	1PTH	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B	3DEU	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B,C,D	2E1Q	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B	3HGX	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B	3BPX	0.85
SAL	2-HYDROXYBENZOIC ACID	A	1WYG	0.85
SAL	2-HYDROXYBENZOIC ACID	A	1JGS	0.85
SAL	2-HYDROXYBENZOIC ACID	X	1M6E	0.85
SAL	2-HYDROXYBENZOIC ACID	A	3B9M	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B	1FO4	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B	1Y7I	0.85
SAL	2-HYDROXYBENZOIC ACID	A,B	2FN1	0.85
201	3-AMIDO-5-BIPHENYL-BENZOIC ACID	A	2B0M	0.72
3BZ	3-chlorobenzoate	X	2QVZ	0.89
3BZ	3-chlorobenzoate	X	2QVX	0.89
HPX	(2Z,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA-2,4-DIENOIC ACID	A,B,C,D	2DSA	0.79
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.83
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.83
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID	A,B	2BXE	0.74
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID	A,B	3D2T	0.74
ISA	3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID	A	1NX3	0.74
ISA	3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID	A,B	1ALW	0.74
HCC	2',4,4'-TRIHYDROXYCHALCONE	D	1FP1	0.71
2CL	(2,6-DICHLOROPHENYL)ACETIC ACID	A	2IPW	0.76
2CL	(2,6-DICHLOROPHENYL)ACETIC ACID	A	2IS7	0.76
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDL	0.91
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDK	0.91
5PV	5-PHENYLVALERIC ACID	A,B	2AY9	0.81
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFK	0.99
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFQ	0.99
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1Z9Y	0.99
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZH9	0.99
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGE	0.99
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGF	0.99
IBP	IBUPROFEN	A	3FKX	0.8
IBP	IBUPROFEN	A,B	2BXG	0.8
IBP	IBUPROFEN	A,B	1EQG	0.8
IBP	IBUPROFEN	A,B,C	2WD9	0.8
IBP	IBUPROFEN	A	2PWS	0.8
HBD	4-HYDROXYBENZAMIDE	B,C,D	1BEN	0.73
34Z	3,4-dichlorobenzoate	X	2QVY	0.85
34Z	3,4-dichlorobenzoate	X	2QW0	0.85
SN1	2,4-DIHYDROXY-TRANS CINNAMIC ACID	1	1K2I	0.73
PHQ	FORMIC ACID BENZYL ESTER	A,I	2F4O	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1KJO	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2CDR	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2C1E	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	5PAD	0.71
PHQ	FORMIC ACID BENZYL ESTER	E,F	1JXQ	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	2CNO	0.71
PHQ	FORMIC ACID BENZYL ESTER	A,B	1CGL	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ9	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2C2K	0.71
PHQ	FORMIC ACID BENZYL ESTER	A,I	2CNL	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1KJP	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2C2M	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2AZB	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	9HVP	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1ESB	0.71
PHQ	FORMIC ACID BENZYL ESTER	E,F	1DY8	0.71
PHQ	FORMIC ACID BENZYL ESTER	E,I	1PPM	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	1GEC	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1KS7	0.71
PHQ	FORMIC ACID BENZYL ESTER	C	1A8G	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1KKK	0.71
PHQ	FORMIC ACID BENZYL ESTER	T,U,V,W,X,Y	1QDU	0.71
PHQ	FORMIC ACID BENZYL ESTER	E,I	4TMN	0.71
PHQ	FORMIC ACID BENZYL ESTER	E,I	5TMN	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1KTO	0.71
PHQ	FORMIC ACID BENZYL ESTER	A,C	1TG1	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ8	0.71
PHQ	FORMIC ACID BENZYL ESTER	A,B	2G58	0.71
PHQ	FORMIC ACID BENZYL ESTER	Q,R,S,T,U,V	1F9E	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2CJY	0.71
PHQ	FORMIC ACID BENZYL ESTER	A,I	1E8M	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1KR6	0.71
PHQ	FORMIC ACID BENZYL ESTER	E,I	6TMN	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1KRO	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2CNN	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2C2O	0.71
PHQ	FORMIC ACID BENZYL ESTER	A,B	1SQZ	0.71
PHQ	FORMIC ACID BENZYL ESTER	A,B	1THE	0.71
PHQ	FORMIC ACID BENZYL ESTER	I,J	2AZC	0.71
PHQ	FORMIC ACID BENZYL ESTER	E,I	5EST	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	2CNK	0.71
PHQ	FORMIC ACID BENZYL ESTER	A	1KL6	0.71
PHQ	FORMIC ACID BENZYL ESTER	I	6PAD	0.71
PHQ	FORMIC ACID BENZYL ESTER	B,I	2C2Z	0.71
DIU	2-HYDROXY-3,5-DIIODO-BENZOIC ACID	A,B	3B56	0.81
DIU	2-HYDROXY-3,5-DIIODO-BENZOIC ACID	A	2BXL	0.81
NLA	NAPHTHALEN-1-YL-ACETIC ACID	A,B,C,D	1LRH	0.75
NLA	NAPHTHALEN-1-YL-ACETIC ACID	B	2P1O	0.75
FHC	2-FLUORO-3-(4-HYDROXYPHENYL)-2E-PROPENEOATE	A	2OPA	0.77
FHC	2-FLUORO-3-(4-HYDROXYPHENYL)-2E-PROPENEOATE	A,B,C	1MFI	0.77
FHC	2-FLUORO-3-(4-HYDROXYPHENYL)-2E-PROPENEOATE	A,B	1GYY	0.77
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.79
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.79
256	PHENYL(SULFO)ACETIC ACID	A	1O4Q	0.75
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3GCL	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2QQT	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1TGM	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2G5J	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1OXR	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3HWY	0.74
HBX	benzaldehyde	A,B	3GDN	0.74
IHB	3-IODO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCI	0.83
PHT	PHTHALIC ACID	A,B,C	2B7P	0.91
PHT	PHTHALIC ACID	A	3C2V	0.91
PHT	PHTHALIC ACID	A,B,C,D,E,F	1QPR	0.91
PHT	PHTHALIC ACID	A,B	3C2R	0.91
156	4-[3-OXO-3-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-YL)-PROPENYL]-BENZOIC ACID	A	1FCZ	0.79
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.74
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.77
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.77
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.77
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.77
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.8
4AF	4-ACETYL-L-PHENYLALANINE	A	1ZH6	0.71
FBC		A,B	2B9A	0.86
OBZ	O-benzylhydroxylamine	A,B	3DTH	0.7
OBZ	O-benzylhydroxylamine	A,B	3DTG	0.7
BFL		A,B	1Q4G	0.78
BJI	1(R)-1-ACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID	A	1ERM	0.75
SS2	(1R)-1-PHENYLETHANOL	A	1ZK0	0.72
SS2	(1R)-1-PHENYLETHANOL	A	1ZJZ	0.72
SS2	(1R)-1-PHENYLETHANOL	A	1ZJY	0.72
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.83
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B	1KDG	0.89
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B,C,D	1O9L	0.89
PAC	2-PHENYLACETIC ACID	B	1PNL	0.85
PAC	2-PHENYLACETIC ACID	B	1K5Q	0.85
PAC	2-PHENYLACETIC ACID	B	1FXH	0.85
PAC	2-PHENYLACETIC ACID	A	2ISF	0.85
PAC	2-PHENYLACETIC ACID	A	2INE	0.85
DBE	bis(4-hydroxyphenyl)methanone	A	2VKU	0.78
GRE	2,6-DIHYDROXYBENZOIC ACID	A,B,C,D	2DVU	0.8
FLP	FLURBIPROFEN	A,B,C,D	3PGH	0.76
FLP	FLURBIPROFEN	A,B	1CQE	0.76
FLP	FLURBIPROFEN	A,B	1EQH	0.76
FLP	FLURBIPROFEN	A,B	2AYL	0.76
FLP	FLURBIPROFEN	A	1DVT	0.76
FLP	FLURBIPROFEN	A	1R9O	0.76
3HP	3-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCE	0.77
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.82
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.82
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.82
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.82
MBO	MERCURIBENZOIC ACID	A	2QO8	1
MBO	MERCURIBENZOIC ACID	A	1LUG	1
MBO	MERCURIBENZOIC ACID	A	2HOC	1
MBO	MERCURIBENZOIC ACID	A	3EFI	1
MBO	MERCURIBENZOIC ACID	A	3BL0	1
MBO	MERCURIBENZOIC ACID	A,B,C,D,E,F	1NAQ	1
MBO	MERCURIBENZOIC ACID	A	3CAJ	1
MBO	MERCURIBENZOIC ACID	A	1DR7	1
MBO	MERCURIBENZOIC ACID	A	2HL4	1
MBO	MERCURIBENZOIC ACID	A	2GD8	1
MBO	MERCURIBENZOIC ACID	A	2QP6	1
MBO	MERCURIBENZOIC ACID	A	2HD6	1
MBO	MERCURIBENZOIC ACID	A	3C7P	1
MBO	MERCURIBENZOIC ACID	A,B	2JHN	1
MBO	MERCURIBENZOIC ACID	A	1DR6	1
MBO	MERCURIBENZOIC ACID	A	2HNC	1
MBO	MERCURIBENZOIC ACID	A	2QOA	1
DFB	2,3-DIFLUOROBENZYL ALCOHOL	A,B	1QV7	0.74
DFB	2,3-DIFLUOROBENZYL ALCOHOL	A,B,C,D	1MG0	0.74
PPT	3-(P-TOLYL)PROPIONIC ACID	A,B	2AY4	0.79
262	2-FORMYLPHENYL DIHYDROGEN PHOSPHATE	A	1O4D	0.73
PPY	3-PHENYLPYRUVIC ACID	A,B	2Q5O	0.79
PPY	3-PHENYLPYRUVIC ACID	A,B	1LCO	0.79
PPY	3-PHENYLPYRUVIC ACID	A,B,C,D,E,F	2ZF4	0.79
PPY	3-PHENYLPYRUVIC ACID	A,B	1BW9	0.79
DPH	DEAMINO-METHYL-PHENYLALANINE	A	1OS0	0.79
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJI	0.79
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJJ	0.79
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2VS2	0.79
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	1OD1	0.79
DPH	DEAMINO-METHYL-PHENYLALANINE	E	1EPR	0.79
HCI	HYDROCINNAMIC ACID	A,B	1BXG	0.82
HCI	HYDROCINNAMIC ACID	A,B	1TOG	0.82
HCI	HYDROCINNAMIC ACID	A,B	1V2F	0.82
HCI	HYDROCINNAMIC ACID	A,B	1AHX	0.82
HCI	HYDROCINNAMIC ACID	A	1TOI	0.82
HCI	HYDROCINNAMIC ACID	A,B	1AY8	0.82
HCI	HYDROCINNAMIC ACID	A	1TOJ	0.82
2PB	2-[(DIOXIDOPHOSPHINO)OXY]BENZOATE	A	1SDE	0.76
4HP	4-HYDROXYPHENYLACETATE	A,B,C,D	2JBT	0.81
4HP	4-HYDROXYPHENYLACETATE	A	2YYJ	0.81
4HP	4-HYDROXYPHENYLACETATE	A	2YYM	0.81
4HP	4-HYDROXYPHENYLACETATE	B	1AI6	0.81
4HP	4-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCG	0.81
3HB	3-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCB	0.87
3HB	3-HYDROXYBENZOIC ACID	A	2DKH	0.87
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A,B	2P0M	0.71
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A	1LOX	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.81
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.81
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.81
HPK	(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE	A	2PUH	0.77
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	0,1,3,4,5,9,A,B,C,H,J,K,L,M,N,O,Q,R,S,T,U,Y,Z	1VQ6	0.76
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	A,B	1C1X	0.76
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	0,1,3,4,9,A,B,C,D,F,H,J,K,L,M,N,O,Q,R,S,T,U,Y,Z	1VQP	0.76
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	0,1,2,3,4,5,9,A,B,C,D,F,H,J,K,L,M,N,O,Q,R,S,T,U,Y,Z	1VQN	0.76
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	I	1QRP	0.76
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	A	2CTC	0.76
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	I	1E82	0.76
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	I	1E81	0.76
FE3	4-(2-aminoethyl)-3-chlorobenzoic acid	A,B	2K1Q	0.74
26C		A,B	2F7I	0.86
SMN	(S)-MANDELIC ACID	A	1MDL	0.82
IOB	3-IODO-BENZYL ALCOHOL	A,B	1QK0	0.74
PHB	P-HYDROXYBENZOIC ACID	A	1CJ4	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1DOB	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1PXB	0.86
PHB	P-HYDROXYBENZOIC ACID	A,B	1G1B	0.86
PHB	P-HYDROXYBENZOIC ACID	A,B	1YKJ	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1IUV	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1PBE	0.86
PHB	P-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCC	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1PDH	0.86
PHB	P-HYDROXYBENZOIC ACID	B	2BUW	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1CC4	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1CC6	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1IUW	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1FW9	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1G81	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1BGJ	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1IUX	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1CJ3	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1D7L	0.86
PHB	P-HYDROXYBENZOIC ACID	A	2PHH	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1BGN	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1PXA	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1DOC	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1K0I	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1BKW	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1JD3	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1PXC	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1TT8	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1CJ2	0.86
PHB	P-HYDROXYBENZOIC ACID	A,B	1Q4S	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1BF3	0.86
PHB	P-HYDROXYBENZOIC ACID	B	2BUR	0.86
B3I	2,3,5-TRIIODOBENZOIC ACID	A	1BKE	0.93
C1E	(2Z,4E)-3-chloro-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid	A	2RHT	0.77
173	BENZOYL-FORMIC ACID	A,B	1SZE	0.88
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1DOD	0.79
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1DOE	0.79
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1PBB	0.79
HBA	P-HYDROXYBENZALDEHYDE	A	1K03	0.8
HBA	P-HYDROXYBENZALDEHYDE	A,B	2VQ5	0.8
HBA	P-HYDROXYBENZALDEHYDE	A,B	1EB9	0.8
HBA	P-HYDROXYBENZALDEHYDE	A	2GQ9	0.8
HBA	P-HYDROXYBENZALDEHYDE	A,B	1Z42	0.8
HBA	P-HYDROXYBENZALDEHYDE	A	1OYB	0.8
34D	3,5-DIHYDROXYBENZOATE	A,B	2BX7	0.8
12M	(2-ETHYLPHENYL)METHANOL	A,B	2F62	0.72
AC6	P-HYDROXYACETOPHENONE	A	2GQ8	0.79
AC6	P-HYDROXYACETOPHENONE	X	2O48	0.79
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.76
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.76
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.76
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.76
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.76
PMA	PYROMELLITIC ACID	A,B	1FUP	0.82
TCA	PHENYLETHYLENECARBOXYLIC ACID	A	1BE6	0.78
TCA	PHENYLETHYLENECARBOXYLIC ACID	A	1BE8	0.78
TCA	PHENYLETHYLENECARBOXYLIC ACID	A,B,C,D,E,F,G,H	2O78	0.78
FHI		A,B	1Y1D	0.73
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	3CMP	0.77
DBH	2,3-DIHYDROXY-BENZOIC ACID	A	1MD9	0.77
DBH	2,3-DIHYDROXY-BENZOIC ACID	A	1MDB	0.77
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	1L6M	0.77
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	3BY0	0.77
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.72
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B	2TPL	0.8
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B,C,D	3GGP	0.8
SGI	3-(4-hydroxyphenyl)propanamide	A,B	2R9K	0.7
SHA	SALICYLHYDROXAMIC ACID	X	1V0H	0.71
SHA	SALICYLHYDROXAMIC ACID	A	2QPK	0.71
SHA	SALICYLHYDROXAMIC ACID	A	3FNL	0.71
SHA	SALICYLHYDROXAMIC ACID	A	3GCJ	0.71
SHA	SALICYLHYDROXAMIC ACID	A	1CK6	0.71
HHH	(2S)-hydroxy(4-hydroxyphenyl)ethanoic acid	A,B	2R5V	0.73
OPH	2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER	E,I	1PPM	0.74
OPH	2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER	E,I	1PPL	0.74
FHB	3-FLUORO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCF	0.83
NIU	6,7,8,9-TETRAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN-2-ONE	A	6UPJ	0.73
CLT	4-PHENYL-BUTANOIC ACID	A	1THL	0.81
CLT	4-PHENYL-BUTANOIC ACID	A,B	2AY7	0.81
CLT	4-PHENYL-BUTANOIC ACID	E,I	1TMN	0.81
JUG	5-hydroxynaphthalene-1,4-dione	A,B,C,D,E,F	3B7J	0.74