Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01957942

Ligand	Ligand name	Chain	PDB	Tanimoto
201	3-AMIDO-5-BIPHENYL-BENZOIC ACID	A	2B0M	0.75
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	M,N,O,P,Q,R	3PCN	0.74
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	B	1AI4	0.74
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B,C,D	1Q0C	0.74
DHY	2-(3,4-DIHYDROXYPHENYL)ACETIC ACID	A,B	1F1V	0.74
BJP	(1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID	A	1ERO	0.74
DBE	bis(4-hydroxyphenyl)methanone	A	2VKU	0.79
DHC	CAFFEIC ACID	A,B,C,D,E,F,G,H	2O7D	0.72
DHC	CAFFEIC ACID	A	1KOU	0.72
FBC		A,B	2B9A	0.88
BHC	BENZENE HEXACARBOXYLIC ACID	A,B,C,D	1BQ4	0.73
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.87
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.87
NDH	(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-DIHYDRONAPHTHALENE	A,B	1O7P	0.75
CLT	4-PHENYL-BUTANOIC ACID	A	1THL	0.74
CLT	4-PHENYL-BUTANOIC ACID	A,B	2AY7	0.74
CLT	4-PHENYL-BUTANOIC ACID	E,I	1TMN	0.74
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.75
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.75
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.75
PIC	6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE-2-CARBOXYLIC ACID	A	1BZJ	0.8
FLP	FLURBIPROFEN	A,B,C,D	3PGH	0.77
FLP	FLURBIPROFEN	A,B	1CQE	0.77
FLP	FLURBIPROFEN	A,B	1EQH	0.77
FLP	FLURBIPROFEN	A,B	2AYL	0.77
FLP	FLURBIPROFEN	A	1DVT	0.77
FLP	FLURBIPROFEN	A	1R9O	0.77
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
HOP	(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-5-PHENYL-1-CYCLOHEXANOL	H,L	1D6V	0.7
HOP	(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-5-PHENYL-1-CYCLOHEXANOL	A,B,H,L	1AXS	0.7
3HB	3-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCB	0.77
3HB	3-HYDROXYBENZOIC ACID	A	2DKH	0.77
HHH	(2S)-hydroxy(4-hydroxyphenyl)ethanoic acid	A,B	2R5V	0.79
IBP	IBUPROFEN	A	3FKX	0.75
IBP	IBUPROFEN	A,B	2BXG	0.75
IBP	IBUPROFEN	A,B	1EQG	0.75
IBP	IBUPROFEN	A,B,C	2WD9	0.75
IBP	IBUPROFEN	A	2PWS	0.75
HCI	HYDROCINNAMIC ACID	A,B	1BXG	0.73
HCI	HYDROCINNAMIC ACID	A,B	1TOG	0.73
HCI	HYDROCINNAMIC ACID	A,B	1V2F	0.73
HCI	HYDROCINNAMIC ACID	A,B	1AHX	0.73
HCI	HYDROCINNAMIC ACID	A	1TOI	0.73
HCI	HYDROCINNAMIC ACID	A,B	1AY8	0.73
HCI	HYDROCINNAMIC ACID	A	1TOJ	0.73
NIU	6,7,8,9-TETRAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN-2-ONE	A	6UPJ	0.71
ADL	(1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID	A,B	1N5S	0.74
OAL	(1,8-DIHYDROXY-9,10-DIOXO-9,10-DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID	B	1N5T	0.74
IHB	3-IODO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCI	0.73
254	6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALEN-2-YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FD0	0.72
KPV	5-PHENYL-2-KETO-VALERIC ACID	A,B	2Q5Q	0.73
23A	2,3-DIHYDROXYBENZALDEHYDE	A,B,C,D	2DVX	0.73
PPP	3-PHENYL-1,2-PROPANDIOL	A,B	1HRN	0.72
TRZ	TRAZEOLIDE	A	1C12	0.71
BFL		A,B	1Q4G	0.79
CP5	(2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}-2-PHENYLACRYLATE	A	1SCW	0.73
BPA	7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE	A	1JDG	0.7
SMN	(S)-MANDELIC ACID	A	1MDL	0.86
AC6	P-HYDROXYACETOPHENONE	A	2GQ8	0.74
AC6	P-HYDROXYACETOPHENONE	X	2O48	0.74
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B	1D83	0.71
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B	1EKH	0.71
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B	1EKI	0.71
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B,C,D	1VAQ	0.71
DPH	DEAMINO-METHYL-PHENYLALANINE	A	1OS0	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJI	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJJ	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2VS2	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	1OD1	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	E	1EPR	0.73
NLA	NAPHTHALEN-1-YL-ACETIC ACID	A,B,C,D	1LRH	0.76
NLA	NAPHTHALEN-1-YL-ACETIC ACID	B	2P1O	0.76
PPT	3-(P-TOLYL)PROPIONIC ACID	A,B	2AY4	0.75
PAC	2-PHENYLACETIC ACID	B	1PNL	0.76
PAC	2-PHENYLACETIC ACID	B	1K5Q	0.76
PAC	2-PHENYLACETIC ACID	B	1FXH	0.76
PAC	2-PHENYLACETIC ACID	A	2ISF	0.76
PAC	2-PHENYLACETIC ACID	A	2INE	0.76
PPY	3-PHENYLPYRUVIC ACID	A,B	2Q5O	0.73
PPY	3-PHENYLPYRUVIC ACID	A,B	1LCO	0.73
PPY	3-PHENYLPYRUVIC ACID	A,B,C,D,E,F	2ZF4	0.73
PPY	3-PHENYLPYRUVIC ACID	A,B	1BW9	0.73
1NH	(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]-3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE	B	1O1S	0.74
FHB	3-FLUORO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCF	0.73
AKV	{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE	A,B,C,D	2F99	0.73
SS1	1-PHENYLETHANOL	H	1UM5	0.74
PHT	PHTHALIC ACID	A,B,C	2B7P	0.82
PHT	PHTHALIC ACID	A	3C2V	0.82
PHT	PHTHALIC ACID	A,B,C,D,E,F	1QPR	0.82
PHT	PHTHALIC ACID	A,B	3C2R	0.82
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BV0	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B,D,F,H,J,L	1YKP	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1N8Q	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	A,B	2BSL	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKL	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D	1B4U	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	A	3DX5	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCA	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	B,D,F,H,J,L	1YKN	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	B	1EOB	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	A	1PHH	0.74
DHB	3,4-DIHYDROXYBENZOIC ACID	B	2BUV	0.74
295	(2S,3S)-3-(4-fluorophenyl)-2,3-dihydroxypropanoic acid	A,B	2RJR	0.82
2NA	naphthalen-2-ylmethanol	A,B,C	3EE5	0.73
4BA	4-[(2-CARBOXY-ETHYLAMINO)-METHYL]-BENZOIC ACID	C	1FAV	0.72
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXV	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,E	2IBK	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,B,C,D,E,F	2IA6	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1Y9H	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1FYY	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXO	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1DXA	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXL	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,B,D,E,F	1S0M	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1BPS	0.7
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,C	1XC9	0.7
SAL	2-HYDROXYBENZOIC ACID	A	2I2Z	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B,C	1FIQ	0.74
SAL	2-HYDROXYBENZOIC ACID	A	2I30	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B	1PTH	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B	3DEU	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B,C,D	2E1Q	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B	3HGX	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B	3BPX	0.74
SAL	2-HYDROXYBENZOIC ACID	A	1WYG	0.74
SAL	2-HYDROXYBENZOIC ACID	A	1JGS	0.74
SAL	2-HYDROXYBENZOIC ACID	X	1M6E	0.74
SAL	2-HYDROXYBENZOIC ACID	A	3B9M	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B	1FO4	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B	1Y7I	0.74
SAL	2-HYDROXYBENZOIC ACID	A,B	2FN1	0.74
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.79
HBA	P-HYDROXYBENZALDEHYDE	A	1K03	0.73
HBA	P-HYDROXYBENZALDEHYDE	A,B	2VQ5	0.73
HBA	P-HYDROXYBENZALDEHYDE	A,B	1EB9	0.73
HBA	P-HYDROXYBENZALDEHYDE	A	2GQ9	0.73
HBA	P-HYDROXYBENZALDEHYDE	A,B	1Z42	0.73
HBA	P-HYDROXYBENZALDEHYDE	A	1OYB	0.73
OAC	TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE	C	3GCH	0.72
34D	3,5-DIHYDROXYBENZOATE	A,B	2BX7	0.73
DIC	3,4-DICHLOROISOCOUMARIN	A	1DIC	0.7
MUF	(8alpha,10alpha,13alpha,17beta)-17-[(4-hydroxyphenyl)carbonyl]androsta-3,5-diene-3-carboxylic acid	A,B	3BEJ	0.71
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.72
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.72
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.72
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.72
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.72
ELI	6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN-2-YL)HEXANOIC ACID	A,B	2GH5	0.76
26C		A,B	2F7I	0.88
791	2-PHENYLMALONIC ACID	A	1O4P	0.74
FL2	FLURBIPROFEN METHYL ESTER	A,B	1HT5	0.73
PSN	BENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE	A	1O4K	0.73
5PV	5-PHENYLVALERIC ACID	A,B	2AY9	0.74
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	H,I	1A2C	0.74
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C	1CA7	0.74
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C,D	3GGO	0.74
MBO	MERCURIBENZOIC ACID	A	2QO8	0.83
MBO	MERCURIBENZOIC ACID	A	1LUG	0.83
MBO	MERCURIBENZOIC ACID	A	2HOC	0.83
MBO	MERCURIBENZOIC ACID	A	3EFI	0.83
MBO	MERCURIBENZOIC ACID	A	3BL0	0.83
MBO	MERCURIBENZOIC ACID	A,B,C,D,E,F	1NAQ	0.83
MBO	MERCURIBENZOIC ACID	A	3CAJ	0.83
MBO	MERCURIBENZOIC ACID	A	1DR7	0.83
MBO	MERCURIBENZOIC ACID	A	2HL4	0.83
MBO	MERCURIBENZOIC ACID	A	2GD8	0.83
MBO	MERCURIBENZOIC ACID	A	2QP6	0.83
MBO	MERCURIBENZOIC ACID	A	2HD6	0.83
MBO	MERCURIBENZOIC ACID	A	3C7P	0.83
MBO	MERCURIBENZOIC ACID	A,B	2JHN	0.83
MBO	MERCURIBENZOIC ACID	A	1DR6	0.83
MBO	MERCURIBENZOIC ACID	A	2HNC	0.83
MBO	MERCURIBENZOIC ACID	A	2QOA	0.83
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)-2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.74
S1A	SORAPHEN A	A,B	3GID	0.72
S1A	SORAPHEN A	A,B,C	1W96	0.72
EJ5	4-[3-(2-amino-4-hydroxy-6-oxo-1,6-dihydropyrimidin-5-yl)propyl]benzoic acid	X	3EJ5	0.71
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.88
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.88
4HP	4-HYDROXYPHENYLACETATE	A,B,C,D	2JBT	0.75
4HP	4-HYDROXYPHENYLACETATE	A	2YYJ	0.75
4HP	4-HYDROXYPHENYLACETATE	A	2YYM	0.75
4HP	4-HYDROXYPHENYLACETATE	B	1AI6	0.75
4HP	4-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCG	0.75
C1E	(2Z,4E)-3-chloro-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid	A	2RHT	0.76
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B	1KDG	0.79
EMT	2-(ETHYLMERCURI-THIO)-BENZOIC ACID	A,B,C,D	1O9L	0.79
OMD	2-(3,6-DIHYDROXYPHENYL)ACETIC ACID	A,B	1AJP	0.72
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1DOD	0.7
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1DOE	0.7
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1PBB	0.7
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B	2TPL	0.75
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B,C,D	3GGP	0.75
AFI	2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]-3,4-DIHYDROXY-1(2H)-NAPHTHALENONE	A,B	1UUM	0.71
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.73
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.73
MN7	1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE	N	1NLO	0.7
564	6-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALENE-2-CARBONYL)-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCY	0.79
JUG	5-hydroxynaphthalene-1,4-dione	A,B,C,D,E,F	3B7J	0.7
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.82
AN1	3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID	H,Y	1LO3	0.7
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID	A,B	2BXE	0.76
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID	A,B	3D2T	0.76
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1F2W	0.83
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2F14	0.83
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1BV3	0.83
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	2AW1	0.83
HGB	4-(HYDROXYMERCURY)BENZOIC ACID	A	1ZE8	0.83
HSI	(3R)-3-{4-[(4-CHLOROPHENYL)ETHYNYL]BENZOYL}NONANOIC ACID	A	2Z2D	0.72
OSB	2-SUCCINYLBENZOATE	A	1FHV	0.86
OSB	2-SUCCINYLBENZOATE	A,B,C,D	1SJB	0.86
OSB	2-SUCCINYLBENZOATE	A,B	2QVH	0.86
PHB	P-HYDROXYBENZOIC ACID	A	1CJ4	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1DOB	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1PXB	0.75
PHB	P-HYDROXYBENZOIC ACID	A,B	1G1B	0.75
PHB	P-HYDROXYBENZOIC ACID	A,B	1YKJ	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1IUV	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1PBE	0.75
PHB	P-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCC	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1PDH	0.75
PHB	P-HYDROXYBENZOIC ACID	B	2BUW	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1CC4	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1CC6	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1IUW	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1FW9	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1G81	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1BGJ	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1IUX	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1CJ3	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1D7L	0.75
PHB	P-HYDROXYBENZOIC ACID	A	2PHH	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1BGN	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1PXA	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1DOC	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1K0I	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1BKW	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1JD3	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1PXC	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1TT8	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1CJ2	0.75
PHB	P-HYDROXYBENZOIC ACID	A,B	1Q4S	0.75
PHB	P-HYDROXYBENZOIC ACID	A	1BF3	0.75
PHB	P-HYDROXYBENZOIC ACID	B	2BUR	0.75
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.84
3CA		A,B	2B77	0.71
MCG	(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE	A,B	1ISS	0.76
DIU	2-HYDROXY-3,5-DIIODO-BENZOIC ACID	A,B	3B56	0.71
DIU	2-HYDROXY-3,5-DIIODO-BENZOIC ACID	A	2BXL	0.71
OPH	2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER	E,I	1PPM	0.78
OPH	2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER	E,I	1PPL	0.78
BZS	L-BENZYLSUCCINIC ACID	A	1CBX	0.73
BZS	L-BENZYLSUCCINIC ACID	A	1HYT	0.73
BZS	L-BENZYLSUCCINIC ACID	A,B	1WHT	0.73
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDL	0.82
TMM	1,3,5-BENZENETRICARBOXYLIC ACID	A,B,C,D	1SDK	0.82
HC4		A	1TS6	0.71
HC4		A	3PHY	0.71
HC4		A	3PYP	0.71
HC4		A	1T1C	0.71
HC4		A	1OT6	0.71
HC4		A	1TS0	0.71
HC4		A	1T1A	0.71
HC4		A	2PYP	0.71
HC4		A	2ZOI	0.71
HC4		A	1OTI	0.71
HC4		A	1XFQ	0.71
HC4		A	2D01	0.71
HC4		A,B,C,D,E,F,G,H	2O7B	0.71
HC4		A	2ZOH	0.71
HC4		A	1GSW	0.71
HC4		A	2QJ7	0.71
HC4		A	1F9I	0.71
HC4		X	1UWP	0.71
HC4		A	2PHY	0.71
HC4		A	1T1B	0.71
HC4		A	1F98	0.71
HC4		A	1T19	0.71
HC4		X	1UWN	0.71
HC4		A,B,C,D,E,F,G,H	2O7F	0.71
HC4		A	1UGU	0.71
HC4		A	1TS8	0.71
HC4		A,B	1OTD	0.71
HC4		A	1OTE	0.71
HC4		A	1GSX	0.71
HC4		A	1TS7	0.71
HC4		A	2PYR	0.71
HC4		A	1S4S	0.71
HC4		A	1GSV	0.71
HC4		A	2I9V	0.71
HC4		A	2QWS	0.71
HC4		A	1XFN	0.71
HC4		A	1S4R	0.71
HC4		A	1T18	0.71
HC4		A	1OTA	0.71
HC4		A	1D7E	0.71
HC4		A	1S1Z	0.71
HC4		A,B,C	1MZU	0.71
HC4		A,B	1ODV	0.71
HC4		A,B	2J3J	0.71
HC4		A	2QJ5	0.71
HC4		A	1OTB	0.71
HC4		A	2D02	0.71
HC4		A	1OT9	0.71
HC4		A	1NWZ	0.71
HC4		A	1S1Y	0.71
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	3CMP	0.74
DBH	2,3-DIHYDROXY-BENZOIC ACID	A	1MD9	0.74
DBH	2,3-DIHYDROXY-BENZOIC ACID	A	1MDB	0.74
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	1L6M	0.74
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	3BY0	0.74
3BZ	3-chlorobenzoate	X	2QVZ	0.76
3BZ	3-chlorobenzoate	X	2QVX	0.76
HPK	(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE	A	2PUH	0.73
BEZ	BENZOIC ACID	A,B	2F8D	0.83
BEZ	BENZOIC ACID	A,B	1A8U	0.83
BEZ	BENZOIC ACID	A,B	1REE	0.83
BEZ	BENZOIC ACID	A	1L7Q	0.83
BEZ	BENZOIC ACID	A	1I69	0.83
BEZ	BENZOIC ACID	H,L	1RUL	0.83
BEZ	BENZOIC ACID	A,B	3CCF	0.83
BEZ	BENZOIC ACID	A	1W9Q	0.83
BEZ	BENZOIC ACID	A,B,G,J	2DU8	0.83
BEZ	BENZOIC ACID	H,L	1RUA	0.83
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H	1H4O	0.83
BEZ	BENZOIC ACID	H,L	1RU9	0.83
BEZ	BENZOIC ACID	A,B,C,D	2V32	0.83
BEZ	BENZOIC ACID	A	2QMQ	0.83
BEZ	BENZOIC ACID	A	1UKB	0.83
BEZ	BENZOIC ACID	A,B	1RED	0.83
BEZ	BENZOIC ACID	A,B	1OC3	0.83
BEZ	BENZOIC ACID	A,B	1REF	0.83
BEZ	BENZOIC ACID	A,B	2O02	0.83
BEZ	BENZOIC ACID	A,B	2VJ1	0.83
BEZ	BENZOIC ACID	A,B,C	1WSP	0.83
BEZ	BENZOIC ACID	A	1HZ4	0.83
BEZ	BENZOIC ACID	A	2Q38	0.83
BEZ	BENZOIC ACID	A,B,C,D	1UUJ	0.83
BEZ	BENZOIC ACID	A,B	2QL8	0.83
BEZ	BENZOIC ACID	A	2Q0I	0.83
BEZ	BENZOIC ACID	A,B	1S8F	0.83
BEZ	BENZOIC ACID	D,E,F,G,H	1DJR	0.83
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H,I	1ONI	0.83
BEZ	BENZOIC ACID	A,B,C,D	1I7Q	0.83
BEZ	BENZOIC ACID	A,B,C,D	2RHM	0.83
BEZ	BENZOIC ACID	A,B	2F78	0.83
BEZ	BENZOIC ACID	A,B	2VL2	0.83
BEZ	BENZOIC ACID	A	1HD2	0.83
BEZ	BENZOIC ACID	A	1JU4	0.83
BEZ	BENZOIC ACID	H,L	2AJY	0.83
BEZ	BENZOIC ACID	A,B,C	3GV1	0.83
BEZ	BENZOIC ACID	A	2Q6U	0.83
BEZ	BENZOIC ACID	A,B	1VE9	0.83
BEZ	BENZOIC ACID	A,B	1S9A	0.83
BEZ	BENZOIC ACID	H,L,M	1OP3	0.83
BEZ	BENZOIC ACID	A	1W9E	0.83
BEZ	BENZOIC ACID	A,B,C,D	2V2G	0.83
BEZ	BENZOIC ACID	H,L	2AK1	0.83
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H	2V41	0.83
BEZ	BENZOIC ACID	A,B	1GYX	0.83
BEZ	BENZOIC ACID	A	1V1T	0.83
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H,I,J,K,L	1YAJ	0.83
BEZ	BENZOIC ACID	A,B	1HKQ	0.83
BEZ	BENZOIC ACID	H,L	1RUK	0.83
BEZ	BENZOIC ACID	A	2Q1B	0.83
BEZ	BENZOIC ACID	H,L	1RUM	0.83
BEZ	BENZOIC ACID	A,B	2F7A	0.83
BEZ	BENZOIC ACID	A,B,C,D,E,F,G,H	1KIF	0.83
BEZ	BENZOIC ACID	A,B	2V7B	0.83
BEZ	BENZOIC ACID	H	1NCW	0.83
BEZ	BENZOIC ACID	A,B	1TMX	0.83
BEZ	BENZOIC ACID	A	1URM	0.83
BEZ	BENZOIC ACID	A	1W9O	0.83
BEZ	BENZOIC ACID	A,B,C,D	1GXS	0.83
BEZ	BENZOIC ACID	H	1RUP	0.83
BEZ	BENZOIC ACID	A,B,C,D	1KQB	0.83
BEZ	BENZOIC ACID	A	2Q9R	0.83
BEZ	BENZOIC ACID	D,H	2OK6	0.83
BEZ	BENZOIC ACID	A,B	2Q0J	0.83
B3I	2,3,5-TRIIODOBENZOIC ACID	A	1BKE	0.78
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5A	0.77
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5C	0.77
OX1		H,Y	1LO2	0.73
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFK	0.82
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZFQ	0.82
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1Z9Y	0.82
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZH9	0.82
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGE	0.82
BE7	(4-CARBOXYPHENYL)(CHLORO)MERCURY	A	1ZGF	0.82
LOB	LOBELINE	A,B,C,D,E,F,G,H,I,J	2BYS	0.75
789	3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)-1H-INDEN-1-ONE	A,B	1ZAF	0.72
219	CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE	A	1O4I	0.7
TBT	8,9,10,11-TETRAHYDRO-BENZO[A]ANTHRACENE-8,9,10-TRIOL	A	1DJD	0.71
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.73
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.82
174	4-CHLORO-BENZOIC ACID	X	3DLP	0.76
174	4-CHLORO-BENZOIC ACID	X	1T5D	0.76
PMA	PYROMELLITIC ACID	A,B	1FUP	0.79
2HC	(2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID	A,B	1V5Z	0.72
VII	2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID	A,B	2GFK	0.71
HCC	2',4,4'-TRIHYDROXYCHALCONE	D	1FP1	0.72
HPZ	(2E,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA-2,4-DIENOIC ACID	A	2PUJ	0.78
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1DL4	0.71
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1I7V	0.71
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1QBY	0.71
GW5	(2E)-3-{4-[(1E)-1,2-DIPHENYLBUT-1-ENYL]PHENYL}ACRYLIC ACID	A,B,C	1R5K	0.7
BPJ	(1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	2ROU	0.71
BPJ	(1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	1HX4	0.71
FHI		A,B	1Y1D	0.74
UIN	5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN-2-ONE	B	5UPJ	0.71
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.81
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.81
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.81
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.81
156	4-[3-OXO-3-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-YL)-PROPENYL]-BENZOIC ACID	A	1FCZ	0.82
BPI	(1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A,P,T	2I9G	0.71
BPI	(1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	1HWV	0.71
HPX	(2Z,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA-2,4-DIENOIC ACID	A,B,C,D	2DSA	0.78
BZQ	DIPHENYLMETHANONE	A,B	1GT5	0.72
BZQ	DIPHENYLMETHANONE	A,B	1DZP	0.72
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3B3K	0.7
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3D6D	0.7
BZR	1S,2R,3S,4R-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1MXJ	0.71
GRR	(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid	A	3CDS	0.7
SS2	(1R)-1-PHENYLETHANOL	A	1ZK0	0.74
SS2	(1R)-1-PHENYLETHANOL	A	1ZJZ	0.74
SS2	(1R)-1-PHENYLETHANOL	A	1ZJY	0.74
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.86
SDN	[(3S)-9-hydroxy-1-methyl-10-oxo-4,10-dihydro-3H-benzo[g]isochromen-3-yl]acetic acid	A,B	3B6C	0.72
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	0.81
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	A,B	1C1X	0.81
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	0.81
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	0.81
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	I	1QRP	0.81
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	A	2CTC	0.81
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	I	1E82	0.81
HFA	ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID	I	1E81	0.81
12M	(2-ETHYLPHENYL)METHANOL	A,B	2F62	0.7
173	BENZOYL-FORMIC ACID	A,B	1SZE	0.79
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.7
34Z	3,4-dichlorobenzoate	X	2QVY	0.72
34Z	3,4-dichlorobenzoate	X	2QW0	0.72
BIP	2-BENZYL-3-IODOPROPANOIC ACID	A,B,C,D	1BAV	0.71
HZ3	dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate	A,B	2QR9	0.73
4FC		A	1YSG	0.89
BJI	1(R)-1-ACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID	A	1ERM	0.72
3HP	3-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCE	0.74
C0E	3-fluoro-6-(4-fluorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid	A	2RHW	0.75
184	6-[HYDROXY-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALEN-2-YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCX	0.83
FE3	4-(2-aminoethyl)-3-chlorobenzoic acid	A,B	2K1Q	0.73
RMN	(R)-MANDELIC ACID	A	1MDL	0.86
RMN	(R)-MANDELIC ACID	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	1MCZ	0.86
BM6	4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN-2-YL]-BENZOIC ACID	A	1MVC	0.76
BM6	4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN-2-YL]-BENZOIC ACID	A,C,E,G	1MZN	0.76
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FR9	0.72
PBF	PARA-(BENZOYL)-PHENYLALANINE	A,B	1EEN	0.72
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2HGZ	0.72
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FRB	0.72
GRE	2,6-DIHYDROXYBENZOIC ACID	A,B,C,D	2DVU	0.71
G50	3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN-1-ONE	A,B	2UXI	0.72
OHP	(2-HYDROXYPHENYL)ACETIC ACID	A	2INZ	0.74
RP4	(1S,4S,5S)-1,4,5-TRIHYDROXY-3-[3-(PHENYLTHIO)PHENYL]CYCLOHEX-2-ENE-1-CARBOXYLIC ACID	A,B,C,D,E,F,G,H,I,J,K,L	2CJF	0.72