MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02355978

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
OHT	4-HYDROXYTAMOXIFEN	A	3ERT	0.78
OHT	4-HYDROXYTAMOXIFEN	A,B	1S9Q	0.78
OHT	4-HYDROXYTAMOXIFEN	A,B	1VJB	0.78
OHT	4-HYDROXYTAMOXIFEN	A,B,C,P,R	2JF9	0.78
OHT	4-HYDROXYTAMOXIFEN	A,B,C,D,E,F	2GPV	0.78
OHT	4-HYDROXYTAMOXIFEN	A	2GPU	0.78
OHT	4-HYDROXYTAMOXIFEN	A	2P7Z	0.78
OHT	4-HYDROXYTAMOXIFEN	A,B	2BJ4	0.78
OHT	4-HYDROXYTAMOXIFEN	A,B	2FSZ	0.78
CRS	M-CRESOL	A,B,C,D	1EV3	0.74
CRS	M-CRESOL	A,B,C,D,E,F	2OMG	0.74
CRS	M-CRESOL	A,B	1UZ9	0.74
CRS	M-CRESOL	A,B,C,D	1ZEH	0.74
CRS	M-CRESOL	A,B,C,D,E,F	1ZEI	0.74
CRS	M-CRESOL	A,C,D,E	7INS	0.74
CRS	M-CRESOL	A,B,C,D,E,G, I,K	1EV6	0.74
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	0.84
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	0.84
RFX	(3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine	A	3GWV	0.78
4TN	(2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)-4-HYDROXYPHENYL]ACRYLIC ACID	A	2P1U	0.73
I0G	(3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL	A,B	2I0G	0.74
I0G	(3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL	A,B,C,D	2I0J	0.74
ZHH	2-(4-METHOXYPHENYL)ETHANAMINE	D,H	2HKR	0.82
369	5-(4-hydroxyphenoxy)-6-(3-hydroxyphenyl)- 7-methylnaphthalen-2-ol	A,B	3DT3	0.72
BZF	BENZOFURAN	A	182L	0.76
HFL	5-(3,3-DIHYDROXYPROPENY)-3-METHOXY- BENZENE-1,2-DIOL	C,F	1KYW	0.72
459	4-[(1S,2S,5S,9R)-5-(HYDROXYMETHYL)- 8,9-DIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL	A,B	2FAI	0.73
261	2-ethoxyphenol	X	2RB1	0.77
SFX	(3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine	A	3GWW	0.78
OBZ	O-benzylhydroxylamine	A,B	3DTH	0.71
OBZ	O-benzylhydroxylamine	A,B	3DTG	0.71
TAX	(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINIUM	A	1FJ5	0.79
4HP	4-HYDROXYPHENYLACETATE	A,B,C,D	2JBT	0.7
4HP	4-HYDROXYPHENYLACETATE	A	2YYJ	0.7
4HP	4-HYDROXYPHENYLACETATE	A	2YYM	0.7
4HP	4-HYDROXYPHENYLACETATE	B	1AI6	0.7
4HP	4-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCG	0.7
G24	[4-(3-BENZYL-4-HYDROXYBENZYL)-3,5- DIMETHYLPHENOXY]ACETIC ACID	A	1Q4X	0.74
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
BR3	(6-METHYL-3,4-DIHYDRO-2H-CHROMEN- 2-YL)METHYLPHOSPHINATE	A	1PE5	0.84
DES	DIETHYLSTILBESTROL	A,B,C,D	1S9P	0.77
DES	DIETHYLSTILBESTROL	A,B	3ERD	0.77
DES	DIETHYLSTILBESTROL	A,B	1TT6	0.77
DES	DIETHYLSTILBESTROL	A,B,C,D	1TZ8	0.77
FLN	2-PHENYL-4H-CHROMEN-4-ONE	A	2G0L	0.73
CMZ	(2S)-1-(2,5-dimethylphenoxy)-3- morpholin-4-ylpropan-2-ol	A	2OF0	0.74
IPB	5-METHYL-2-(1-METHYLETHYL)PHENOL	A,B	1E06	0.74
B76		A,B	2E9D	0.75
MCT	4-METHYLCATECHOL	A	1L4G	0.71
MCT	4-METHYLCATECHOL	A	2EHZ	0.71
MCT	4-METHYLCATECHOL	A,B	1DMH	0.71
8PP	2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL	A,B,C,D	1Y0G	0.77
WST	(3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 9-OL	A,B	2POG	0.74
RNP	(1E,2R)-1-(ISOPROPYLIMINO)-3-(1- NAPHTHYLOXY)PROPAN-2-OL	X	1H46	0.7
JJ3	(3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 6-(METHOXYMETHYL)-1,2,3,3A,4,9B- HEXAHYDROCYCLOPENTA[C]CHROMEN-8- OL	A,B	2JJ3	0.73
JJ3	(3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 6-(METHOXYMETHYL)-1,2,3,3A,4,9B- HEXAHYDROCYCLOPENTA[C]CHROMEN-8- OL	A,B	2QE4	0.73
TOM	4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID	A	2IMF	0.77
ETY	4-ethylphenol	A,B,C,D	2RA6	0.79
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A,B	1I7I	0.73
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A	1I7G	0.73
INK	(RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE	A	1HQD	0.78
8PS	5-OCTYL-2-PHENOXYPHENOL	A,B,C,D,E,F	2B37	0.8
CTX	(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINE	A,B,C	1YA4	0.83
BGG	CARBONIC ACID MONOBENZYL ESTER	B,D	1DLK	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
SC4	1[2-CHLORO-4-METHOXY-PHENYL-OXYMETHYL]- 4-[2,6-DICHLORO-PHENYL-OXYMETHYL]- BENZENE	1,4	1EAH	0.75
SC4	1[2-CHLORO-4-METHOXY-PHENYL-OXYMETHYL]- 4-[2,6-DICHLORO-PHENYL-OXYMETHYL]- BENZENE	1,4	3EPF	0.75
H53	2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL	A	2FF5	0.72
H53	2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL	A	2FET	0.72
COU	COUMARIN	A	3CRB	0.79
COU	COUMARIN	A	2PMJ	0.79
COU	COUMARIN	A	2H90	0.79
COU	COUMARIN	A,B,C,D	1Z10	0.79
COU	COUMARIN	A	2PWB	0.79
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
VIV	(2R)-2,5,7,8-TETRAMETHYL-2-[(4R,8R)- 4,8,12-TRIMETHYLTRIDECYL]CHROMAN- 6-OL	A	1R5L	0.7
VIV	(2R)-2,5,7,8-TETRAMETHYL-2-[(4R,8R)- 4,8,12-TRIMETHYLTRIDECYL]CHROMAN- 6-OL	A	1OIP	0.7
5PP	5-PENTYL-2-PHENOXYPHENOL	A,B,C,D,E,F	2B36	0.8
MBD	3-METHYLCATECHOL	A	1KNF	0.7
ZZ1	4-METHYL-2H-CHROMEN-2-ONE	A	2CIP	0.83
12M	(2-ETHYLPHENYL)METHANOL	A,B	2F62	0.71
SS1	1-PHENYLETHANOL	H	1UM5	0.73
TRT	FRAGMENT OF TRITON X-100	A,E	2I0U	0.89
TRT	FRAGMENT OF TRITON X-100	A,B	1OIZ	0.89
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.71
2NI	N-{2-[(4'-CYANO-1,1'-BIPHENYL-4- YL)OXY]ETHYL}-N'-HYDROXY-N-METHYLUREA	A	1ZP5	0.7
B65	(1R)-4-(3-phenoxyphenyl)-1-phosphonobutane- 1-sulfonic acid	A	2ZCQ	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3GCL	0.71
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2QQT	0.71
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1TGM	0.71
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2G5J	0.71
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1OXR	0.71
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3HWY	0.71
PZM	1-(4-METHOXYPHENYL)METHANAMINE	A,D,H	2HJB	0.79
DBA	(2,6-DIMETHYL-PHENOXY)-ACETIC ACID	A,B	1IDB	0.8
HOM	7-HYDROXY-4-METHYL-3-(2-HYDROXY- ETHYL)COUMARIN	C,D	1CJF	0.73
PHQ	FORMIC ACID BENZYL ESTER	A,I	2F4O	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KJO	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2CDR	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2C1E	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	5PAD	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,F	1JXQ	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	2CNO	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,B	1CGL	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ9	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2C2K	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,I	2CNL	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KJP	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2C2M	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2AZB	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	9HVP	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1ESB	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,F	1DY8	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	1PPM	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	1GEC	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KS7	0.74
PHQ	FORMIC ACID BENZYL ESTER	C	1A8G	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KKK	0.74
PHQ	FORMIC ACID BENZYL ESTER	T,U,V,W,X,Y	1QDU	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	4TMN	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	5TMN	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KTO	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,C	1TG1	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ8	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,B	2G58	0.74
PHQ	FORMIC ACID BENZYL ESTER	Q,R,S,T,U,V	1F9E	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2CJY	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,I	1E8M	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KR6	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	6TMN	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KRO	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2CNN	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2C2O	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,B	1SQZ	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,B	1THE	0.74
PHQ	FORMIC ACID BENZYL ESTER	I,J	2AZC	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	5EST	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2CNK	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KL6	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	6PAD	0.74
PHQ	FORMIC ACID BENZYL ESTER	B,I	2C2Z	0.74
RSO	R-STYRENE OXIDE	A,B	1PWZ	0.78
4BR	2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE	A	1PE7	0.89
DID	4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDE	A,B,C,D	1RPW	0.74
440	3-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane- 1-thiol	A	3B92	0.71
JT6	3-[(4'-cyanobiphenyl-4-yl)oxy]- N-hydroxypropanamide	A	2JT6	0.72
PET	1,5-DI(4-AMIDINOPHENOXY)-3-OXA- PENTANE	B	166D	0.73
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	0.8
OXN	OXTOXYNOL-10	A	1IKT	0.84
OXN	OXTOXYNOL-10	A,B	2Q32	0.84
OXN	OXTOXYNOL-10	A,B	1UEH	0.84
OXN	OXTOXYNOL-10	A,B	2D4Q	0.84
DR6	ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]- OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL)	C,I,T	1YTZ	0.83
TNT	1,3-BIS(AMIDINOPHENOXY)PROPANE	B	102D	0.73
TNT	1,3-BIS(AMIDINOPHENOXY)PROPANE	A	1PRP	0.73
FIL	(1E)-1-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]ETHANONE O- (AMINOCARBONYL)OXIME	A,B	1XLZ	0.73
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	0.72
DHR	(2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE	A,B	1E55	0.72
2C2	(2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID	A	2IME	0.73
2C2	(2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID	A	2IMD	0.73
FCR	ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL	A,B	1E0Y	0.72
FCR	ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL	A,B	1E8G	0.72
PFL	2,6-BIS(1-METHYLETHYL)PHENOL	A,B	1E7A	0.75
1OH	4-(1-methyl-1-phenylethyl)phenol	A	2ZAS	0.75
T4A		C,D	1KGI	0.72
T4A		A,B	1Z7J	0.72
34C	(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID	A,B	1HT8	0.75
EGT	2-(3,4,5-TRIHYDROXY-PHENYL)-CHROMAN- 3,5,7-TRIOL	A	1JNQ	0.7
LYL	2-ALLYL-6-METHYL-PHENOL	A	1OV7	0.76
PCR	P-CRESOL	A	1JHV	0.77
PCR	P-CRESOL	A	1JHU	0.77
PCR	P-CRESOL	A,B,C,D	1DIQ	0.77
ZHZ	2-(4-METHOXYPHENYL)ACETAMIDE	D,H	2HKR	0.76
YZ9	7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER	A,B,C	1GCZ	0.72
BPM	4-PHOSPHONOOXY-PHENYL-METHYL-[4- PHOSPHONOOXY]BENZEN	A	1AAX	0.71
SAG	(S)-(+)-2-[4-(FLUOROBENZYLOXY-BENZYLAMINO)PROPIONAMIDE]	A,B	2V5Z	0.71
VIT	VITAMIN E	A,B	1KPM	0.7
VIT	VITAMIN E	A,B	3CXI	0.7
VIT	VITAMIN E	A,B	3CYL	0.7
EPT	HEPTANYL-P-PHENOL	A,B	1AHZ	0.8
TXF	(Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}- 5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL	A,B,C,D,E	2EWP	0.77
POT	(1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE	A	2NW6	0.78
BPZ	4,4'-cyclohexane-1,1-diyldiphenol	A	2ZKC	0.71
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3B3K	0.74
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3D6D	0.74
LJ1	2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol	A,B	3CN0	0.74
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2E2R	0.74
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2P7G	0.74
458	4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 8-METHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL	A,B	2B1V	0.74
2MP	3,4-DIMETHYLPHENOL	A	1L5O	0.76
689	4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 6,8,9-TRIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL	A,B	1ZKY	0.73
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B	2TPL	0.71
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B,C,D	3GGP	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
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2QZZ	0.73
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2R2G	0.73
EPL	DIETHYL 4-METHOXYPHENYL PHOSPHATE	A	2R1N	0.77
T3O	4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3- OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL	A,B	2G44	0.75
MSB	1-METHYLOXY-4-SULFONE-BENZENE	A	1EUB	0.72
MSB	1-METHYLOXY-4-SULFONE-BENZENE	A	1BM6	0.72
NOA	NAPHTHYLOXYACETIC ACID	A,B,I	1HIV	0.75
NOA	NAPHTHYLOXYACETIC ACID	I	1IVP	0.75
2PM	N-[2-(BENZHYDRYLOXY)ETHYL]-N,N- DIMETHYLAMINE	A,B	2AOT	0.71
4FE	(2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid	A	3CBG	0.73
4HC	4-HYDROXY-2H-CHROMEN-2-ONE	A,B	1V5Y	0.75
3AS	(3aS,4R,9bR)-2,2-difluoro-4-(4- hydroxyphenyl)-6-(methoxymethyl)- 1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen- 8-ol	A,B	2QTU	0.7
EYK	2-tert-butylbenzene-1,4-diol	D,F	3EYM	0.71
EYK	2-tert-butylbenzene-1,4-diol	B	3EYK	0.71
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.77
4MU	7-hydroxy-4-methyl-2H-chromen-2- one	A,B	3ETS	0.75
GRR	(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid	A	3CDS	0.78
EUG	2-METHOXY-4-VINYL-PHENOL	A	2QU9	0.79
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1QLU	0.79
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1J	0.79
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	2VAO	0.79
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1K	0.79
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1DZN	0.79
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1L	0.79
EUG	2-METHOXY-4-VINYL-PHENOL	A,B	1W1M	0.79
YRG	(2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid	A	3CDP	0.7
HV7	1-METHYLAMINE-2-HYDROXY-4-METHOXY- BENZENE	C	1A8G	0.7
DC8	(3AS,4R,9BR)-2,2-DIFLUORO-4-(4- HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL	A,B	2Q70	0.72
DC8	(3AS,4R,9BR)-2,2-DIFLUORO-4-(4- HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL	A,B	2Z4B	0.72
268	2-phenoxyethanol	A	2RBR	0.8
258	(2-chloroethoxy)benzene	X	2RAY	0.81
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A,C,E	1KYZ	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A	1JT2	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A	6ATJ	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A,B	1GKL	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A	1GWT	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A,B,C	2BJH	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A	1GW2	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A	3CBG	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A	2BNJ	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A,B	1UWC	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID	A	7ATJ	0.73
MPP	3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID	A,B	2AY3	0.76
505	(2R)-1-(2,6-dimethylphenoxy)propan- 2-amine	A	2VIN	0.82
TN1	5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL	A	1YSG	0.71
HXS	4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol	A,B	3CV6	0.74
2LP	2-ALLYLPHENOL	A	1OV5	0.77
TF5	2-[(2',3',4'-TRIFLUOROBIPHENYL- 2-YL)OXY]ETHANOL	A,B	2OP3	0.81
BOP	1-BROMO-4-METHOXYBENZENE	C,F	1RHQ	0.73
SS2	(1R)-1-PHENYLETHANOL	A	1ZK0	0.73
SS2	(1R)-1-PHENYLETHANOL	A	1ZJZ	0.73
SS2	(1R)-1-PHENYLETHANOL	A	1ZJY	0.73
TON	2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL	A,B	1SEZ	0.87
PNT	1,5-BIS(4-AMIDINOPHENOXY)PENTANE	X	3CR4	0.73
PNT	1,5-BIS(4-AMIDINOPHENOXY)PENTANE	B	1D64	0.73
PNT	1,5-BIS(4-AMIDINOPHENOXY)PENTANE	X	3CR5	0.73
PNT	1,5-BIS(4-AMIDINOPHENOXY)PENTANE	A,B,D,E	1RKW	0.73