Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01339589

Ligand	Ligand name	Chain	PDB	Tanimoto
SMA	STIGMATELLIN A	A,C,D,E,N,P,Q,R	3H1I	0.71
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,O,P,Q,R,S,T	1PPJ	0.71
SMA	STIGMATELLIN A	A,C,D,E,L,N,O,P,W	3CXH	0.71
SMA	STIGMATELLIN A	C,D,E,P,Q,R	1ZRT	0.71
SMA	STIGMATELLIN A	C,H,L,M	2JBL	0.71
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,I,N,O,P,Q,R,S,T,U,V,W	2A06	0.71
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L	2QJP	0.71
SMA	STIGMATELLIN A	A,C,D,E	1KB9	0.71
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2QJK	0.71
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,N,O,P,Q,R,S,T	1PP9	0.71
SMA	STIGMATELLIN A	C,D,E	2IBZ	0.71
SMA	STIGMATELLIN A	A,C,D,E,L,N,O,P,W	3CX5	0.71
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2FYN	0.71
SMA	STIGMATELLIN A	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R	2QJY	0.71
SMA	STIGMATELLIN A	C,D,E	1EZV	0.71
SMA	STIGMATELLIN A	C,D,E,N,O,P,W	1KYO	0.71
SMA	STIGMATELLIN A	A,C,D,E,G,N,P,Q,R,S	3H1J	0.71
SMA	STIGMATELLIN A	C,D,E	1SQX	0.71
4TN	(2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)-4-HYDROXYPHENYL]ACRYLIC ACID	A	2P1U	0.85
HOM	7-HYDROXY-4-METHYL-3-(2-HYDROXY-ETHYL)COUMARIN	C,D	1CJF	0.72
MAX	MATAIRESINOL	A	2BGM	0.79
NOA	NAPHTHYLOXYACETIC ACID	A,B,I	1HIV	0.76
NOA	NAPHTHYLOXYACETIC ACID	I	1IVP	0.76
SWF	S-WARFARIN	A,B	1OG5	0.76
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.75
156	4-[3-OXO-3-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-YL)-PROPENYL]-BENZOIC ACID	A	1FCZ	0.77
RUT	RUTIN	A,B	1RY8	0.71
K05	(E)-3,4-DIHYDROXY-N'-[(2-METHOXYNAPHTHALEN-1-YL)METHYLENE]BENZOHYDRAZIDE	A,B	2I5J	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
NBF	[(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACID	A	1NY0	0.71
NBF	[(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACID	A,B	1YMS	0.71
3HB	3-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCB	0.72
3HB	3-HYDROXYBENZOIC ACID	A	2DKH	0.72
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	0.85
8MO	METHOXSALEN	A,B,C,D	1Z11	0.71
BYS	2-BENZO[1,3]DIOXOL-5-YLMETHYL-3-BENZYL-SUCCINIC ACID	A,B	1JJE	0.73
DFL	2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1JEP	0.76
VNL	4-HYDROXY-3-METHOXYBENZOATE	A,B,C,D	2AHC	0.75
VNL	4-HYDROXY-3-METHOXYBENZOATE	A	1XLR	0.75
REF	2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione	A	2ZJW	0.73
564	6-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALENE-2-CARBONYL)-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCY	0.78
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.75
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.75
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.75
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.75
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.75
WRR	4-HYDROXY-3-[(1S,3R)-3-HYDROXY-1-PHENYLBUTYL]-2H-CHROMEN-2-ONE	A	1H9Z	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	0.77
MPP	3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID	A,B	2AY3	0.73
B21	5-(2-METHOXYPHENYL)-2-FUROIC ACID	A	2Q93	0.73
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	0.78
369	5-(4-hydroxyphenoxy)-6-(3-hydroxyphenyl)-7-methylnaphthalen-2-ol	A,B	3DT3	0.78
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5A	0.79
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5C	0.79
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID	A,B	2BXE	0.72
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID	A,B	3D2T	0.72
GGT	Trioxacarcin A	A,B	3C2J	0.71
WRS	4-HYDROXY-3-[(1S,3S)-3-HYDROXY-1-PHENYLBUTYL]-2H-CHROMEN-2-ONE	A	1HA2	0.75
DM7	4'-DEOXY-4'-IODODOXORUBICIN	A	1IMR	0.72
DM7	4'-DEOXY-4'-IODODOXORUBICIN	A	1IMS	0.72
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	0.73
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	0.84
E3G	ESTRONE BETA-D-GLUCURONIDE	H,L	1CFV	0.73
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	0.75
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	0.75
SB8	2-(3-BENZOYLPHENOXY)ETHYL(HYDROXY)FORMAMIDE	A	2AIA	0.71
FLN	2-PHENYL-4H-CHROMEN-4-ONE	A	2G0L	0.72
FC3	5-[2-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID	A	2EVC	0.72
FDS	FLUORESCIN	H	4FAB	0.8
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3B3K	0.81
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3D6D	0.81
2E3	(2E)-3-[4-hydroxy-3-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]prop-2-enoic acid	A	3FUG	0.76
BDS	2,3-BIS-BENZO[1,3]DIOXOL-5-YLMETHYL-SUCCINIC ACID	A,B	1JJT	0.72
EQI	EQUILIN	A,B	1EQU	0.7
CRH	1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1-METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)-8,9-DIHYROXY-7-METHYLANTHRACENE	A,B	146D	0.79
CRH	1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1-METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)-8,9-DIHYROXY-7-METHYLANTHRACENE	A,B	207D	0.79
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	L	1FLR	0.79
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A,B	1N0S	0.79
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	C,L	1T66	0.79
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A	1X9Q	0.79
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A,D	2NMV	0.79
B29	[2-(3-DIBENZOFURAN-4-YL-PHENYL)-1-HYDROXY-1-PHOSPHONO-ETHYL]-PHOSPHONIC ACID	A,B	2E98	0.74
B29	[2-(3-DIBENZOFURAN-4-YL-PHENYL)-1-HYDROXY-1-PHOSPHONO-ETHYL]-PHOSPHONIC ACID	A,B	2E93	0.74
A15	3'-3"-DICHLOROPHENOL-1,8-3H-BENZO[DE]ISOCHROMEN-1-ONE	A	1TSL	0.74
SDN	[(3S)-9-hydroxy-1-methyl-10-oxo-4,10-dihydro-3H-benzo[g]isochromen-3-yl]acetic acid	A,B	3B6C	0.76
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	0.76
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A,B	1I7I	0.74
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A	1I7G	0.74
DEO		A,B	1ROS	0.72
MYF	5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O65	0.71
JJ3	(3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-6-(METHOXYMETHYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL	A,B	2JJ3	0.7
JJ3	(3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-6-(METHOXYMETHYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL	A,B	2QE4	0.7
DM4	1-O-DEMETHYL-6-DEOXYDOXORUBICIN	A	1D37	0.7
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.81
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
TOM	4-(2-METHOXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IMF	0.74
U03	4-HYDROXY-7-METHOXY-3-(1-PHENYL-PROPYL)-CHROMEN-2-ONE	A	3UPJ	0.76
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A,B	2RH4	0.75
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A,B	3CSD	0.75
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A,B	2RHR	0.75
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A	1F0Q	0.75
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A	3C13	0.75
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A,B	2RHC	0.75
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A	3BQC	0.75
JUG	5-hydroxynaphthalene-1,4-dione	A,B,C,D,E,F	3B7J	0.7
DXB	1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1-METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)-8,9-DIHYDROXY-7-METHYL-ANTHRACENE	A,B	1BP8	0.79
MYU	3,5,6,7-TETRAHYDROXY-2-(3,4-DIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O64	0.72
ORE	4-(2,7-DIFLUORO-6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)ISOPHTHALIC ACID	H,I	2A9N	0.77
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A,B	1FHY	0.73
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	B	204D	0.73
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A,B	2B2B	0.73
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	B	1FHZ	0.73
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A	203D	0.73
MUF	(8alpha,10alpha,13alpha,17beta)-17-[(4-hydroxyphenyl)carbonyl]androsta-3,5-diene-3-carboxylic acid	A,B	3BEJ	0.73
MGI	methyl 4-(2,3-dihydroxy-5-methylphenoxy)-2-hydroxy-6-methylbenzoate	A	2ZA0	0.74
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PIT	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ1	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PIU	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PKL	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A,B	3D57	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ2	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2QPY	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ0	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NUO	0.75
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A,B	2PIN	0.75
OEF	3,5-DIBROMO-4-(3-ISOPROPYL-PHENOXY)BENZOIC ACID	A	2J4A	0.73
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	0.79
QSO	5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one	A,B	2QYO	0.77
DBE	bis(4-hydroxyphenyl)methanone	A	2VKU	0.72
NGV	METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11-TRIOXO-3,4,6,11-TETRAHYDROTETRACENE-1-CARBOXYLATE	A,B,C,D	2F98	0.79
NGV	METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11-TRIOXO-3,4,6,11-TETRAHYDROTETRACENE-1-CARBOXYLATE	A	1SJW	0.79
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
4FE	(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid	A	3CBG	0.7
U01	3-[1-(4-BROMO-PHENYL)-2-METHYL-PROPYL]-4-HYDROXY-CHROMEN-2-ONE	A	1UPJ	0.71
254	6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALEN-2-YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FD0	0.71
2HI	(2S,3R)-2,7-DIHYDROXY-3-(4-HYDROXYPHENYL)-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1ZG3	0.73
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	H,I	1A2C	0.71
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C	1CA7	0.71
ENO	3-(4-HYDROXY-PHENYL)PYRUVIC ACID	A,B,C,D	3GGO	0.71
FSE	3,7,3',4'-TETRAHYDROXYFLAVONE	B	1XO2	0.73
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.84
HXP	3,6-DIHYDROXY-XANTHENE-9-PROPIONIC ACID	A	1XAN	0.74
DXA	1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1-METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)-8,9-DIHYDROXY-7-(SEC-BUTYL)-ANTHRACENE	A,B	1CP8	0.79
VXX	VANILLATE	A,B	1WB6	0.76
G24	[4-(3-BENZYL-4-HYDROXYBENZYL)-3,5-DIMETHYLPHENOXY]ACETIC ACID	A	1Q4X	0.82
886	N-({4'-[(4-isobutyrylphenoxy)methyl]biphenyl-4-yl}sulfonyl)-D-valine	A,B,C,D	2RJP	0.73
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2QZZ	0.75
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2R2G	0.75
GEN	GENISTEIN	A	1QKM	0.75
GEN	GENISTEIN	A,B	1X7J	0.75
GEN	GENISTEIN	A,B	2QA8	0.75
GEN	GENISTEIN	A	1X7R	0.75
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
697	5-HYDROXY-2-(4-HYDROXYPHENYL)-1-BENZOFURAN-7-CARBONITRILE	A,B	1X76	0.72
DBF	DIBENZOFURAN-4,6-DICARBOXYLIC ACID	B	1DVU	0.75
OFF	2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]-L-THREO-PENTARIC ACID	A	2OFF	0.73
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A	2Z9C	0.71
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A,B	1OOQ	0.71
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A,B,C,D,E,F,G,H	2F1O	0.71
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	0.75
DQH	(2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP5	0.73
DQH	(2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	D,F	2C29	0.73
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,C,E	1KYZ	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1JT2	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	6ATJ	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B	1GKL	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1GWT	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B,C	2BJH	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	1GW2	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	3CBG	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	2BNJ	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A,B	1UWC	0.7
FER	3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID	A	7ATJ	0.7
AGI	5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one	A,B,C,D,E,F	3CF9	0.72
789	3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)-1H-INDEN-1-ONE	A,B	1ZAF	0.72
244	[5-HYDROXY-2-(4-HYDROXYPHENYL)-1-BENZOFURAN-7-YL]ACETONITRILE	A,B	1X78	0.73
244	[5-HYDROXY-2-(4-HYDROXYPHENYL)-1-BENZOFURAN-7-YL]ACETONITRILE	A,B	1X7E	0.73
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3GCL	0.73
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2QQT	0.73
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1TGM	0.73
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2G5J	0.73
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1OXR	0.73
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3HWY	0.73
AKV	{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE	A,B,C,D	2F99	0.79
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	0.73
HE7	4-{[(14beta,17alpha)-3-hydroxyestra-1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid	A,B,C,D	2Z77	0.76
V55	4-hydroxy-3-methoxybenzaldehyde	B,D,E,F	2VSS	0.73
V55	4-hydroxy-3-methoxybenzaldehyde	A,B,D,E,F	2VSU	0.73
ERT	METHYL (4R)-2-ETHYL-2,5,12-TRIHYDROXY-7-METHOXY-6,11-DIOXO-4-{[2,3,6-TRIDEOXY-3-(DIMETHYLAMINO)-BETA-D-RIBO-HEXOPYRANOSYL]OXY}-1H,2H,3H,4H,6H,11H-TETRACENE-1-CARBOXYLATE	A,B	1TW2	0.71
ERT	METHYL (4R)-2-ETHYL-2,5,12-TRIHYDROXY-7-METHOXY-6,11-DIOXO-4-{[2,3,6-TRIDEOXY-3-(DIMETHYLAMINO)-BETA-D-RIBO-HEXOPYRANOSYL]OXY}-1H,2H,3H,4H,6H,11H-TETRACENE-1-CARBOXYLATE	A,B	1TW3	0.71
MAR	4'-EPI-4'-(2-DEOXYFUCOSE)DAUNOMYCIN	A	1D36	0.7
MAR	4'-EPI-4'-(2-DEOXYFUCOSE)DAUNOMYCIN	A	1R68	0.7
MAR	4'-EPI-4'-(2-DEOXYFUCOSE)DAUNOMYCIN	A	1D35	0.7
KMP	3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE	A,B,C,D	1H1M	0.74
KMP	3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2C1Z	0.74
RWF	R-WARFARIN	A,B	2BXD	0.76
VII	2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID	A,B	2GFK	0.76
ADL	(1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID	A,B	1N5S	0.81
OAL	(1,8-DIHYDROXY-9,10-DIOXO-9,10-DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID	B	1N5T	0.81
STG	ESTRIOL 3-(B-D-GLUCURONIDE)	H	2BFV	0.72
STG	ESTRIOL 3-(B-D-GLUCURONIDE)	H,L	1BFV	0.72
GW6	(6alpha,11alpha,14beta,16alpha,17alpha)-6,9-difluoro-17-{[(fluoromethyl)sulfanyl]carbonyl}-11-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17-yl furan-2-carboxylate	A,B	3CLD	0.7
PFI	(6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO-4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY-5,6-DIHYDRO-2H-PYRAN-2-ONE	A	2HAI	0.71
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	B,C	1JX1	0.74
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1JX0	0.74
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1FM7	0.74
SIG	STIGMATELLIN	C,D,E	2BCC	0.72
SIG	STIGMATELLIN	C,D,E	3BCC	0.72
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	0.72
BHF	2-PHENYL-4H-BENZO[H]CHROMEN-4-ONE	A	2HI4	0.8
DH2	(2S,3S)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP5	0.73
DH2	(2S,3S)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1GP6	0.73
NOM	7-HYDROXY-5-METHYL-3,3A,5,11B-TETRAHYDRO-1,4-DIOXA-CYCLOPENTA[A]ANTHRACENE-2,6,11-TRIONE	A	1N5V	0.74
DDC	7-HYDROXY-2-PHENYL-CHROMAN-4-ONE	A,B	1FM8	0.73
FL8	6,4'-DIHYDROXY-3-METHYL-3',5'-DIBROMOFLAVONE	B,C	1KGJ	0.73
ZCT		A,B,C,D,E,F,G,H	3B6A	0.76
MOF	MOMETASONE FUROATE	A,B	1SR7	0.7
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.75
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.75
DM3	6-DEOXYDAUNOMYCIN	A	1D14	0.72
R12	9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID	A	3CBS	0.71
IH5	[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-3,5-DIMETHYLPHENYL]ACETIC ACID	A	1NAV	0.72
IH5	[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-3,5-DIMETHYLPHENYL]ACETIC ACID	A	1NAX	0.72
DM2	DOXORUBICIN	A	2DR6	0.72
DM2	DOXORUBICIN	A	1P20	0.72
DM2	DOXORUBICIN	A	1I1E	0.72
DM2	DOXORUBICIN	A	151D	0.72
DM2	DOXORUBICIN	A	1D12	0.72
DM2	DOXORUBICIN	A	1DA9	0.72
DM6	4'-EPIDOXORUBICIN	A	1D15	0.72
DM6	4'-EPIDOXORUBICIN	A	1D54	0.72
DM6	4'-EPIDOXORUBICIN	A	1D58	0.72
DM6	4'-EPIDOXORUBICIN	A	1QDA	0.72
HMO	4'-HYDROXY-7-METHOXYISOFLAVONE	A	1FP2	0.77
GA9	3,3-BIS(3-BROMO-4-HYDROXYPHENYL)-7-CHLORO-1H,3H-BENZO[DE]ISOCHROMEN-1-ONE	A,B,C,D	2A9W	0.7
T4A		C,D	1KGI	0.73
T4A		A,B	1Z7J	0.73
MYC	3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A,B,C,D	3C1T	0.72
MYC	3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O63	0.72
MYC	3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	1E90	0.72
MYC	3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A,B,C,D	2IOD	0.72
NAR	NARINGENIN	A,B	2UXU	0.73
NAR	NARINGENIN	A	2BRT	0.73
NAR	NARINGENIN	A	1CGK	0.73
NAR	NARINGENIN	A,B	1EYQ	0.73
EQU	EQUILENIN	A,B	1OGX	0.76
EQU	EQUILENIN	A,B,C,D,E,F	1QJG	0.76
EQU	EQUILENIN	A,B	1OH0	0.76
EQU	EQUILENIN	A	1W6Y	0.76
EQU	EQUILENIN	A,B	1CQS	0.76
EQU	EQUILENIN	A	1OGZ	0.76
EQU	EQUILENIN	A	1GS3	0.76
EQU	EQUILENIN	A	1OHO	0.76
L41	{4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid	A,B	3D5F	0.79
GRR	(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid	A	3CDS	0.77
DM1	DAUNOMYCIN	A	152D	0.72
DM1	DAUNOMYCIN	A,B,C,D	1O0K	0.72
DM1	DAUNOMYCIN	A	1JO2	0.72
DM1	DAUNOMYCIN	A,B	308D	0.72
DM1	DAUNOMYCIN	A	1D33	0.72
DM1	DAUNOMYCIN	A	110D	0.72
DM1	DAUNOMYCIN	A	1D11	0.72
DM1	DAUNOMYCIN	A	427D	0.72
DM1	DAUNOMYCIN	A	2D34	0.72
DM1	DAUNOMYCIN	A	3F8F	0.72
DM1	DAUNOMYCIN	A	1D10	0.72
DM1	DAUNOMYCIN	A	1DA0	0.72
397	2-(4-HYDROXY-PHENYL)BENZOFURAN-5-OL	A,B	1U9E	0.75
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B	1D83	0.75
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B	1EKH	0.75
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B	1EKI	0.75
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	0.75
MOA	MYCOPHENOLIC ACID	A	1ME7	0.76
MOA	MYCOPHENOLIC ACID	A,B	1JR1	0.76
MOA	MYCOPHENOLIC ACID	A	1MEI	0.76
MOA	MYCOPHENOLIC ACID	A	1MEH	0.76
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F	3BXX	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	2O3P	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B	2UXH	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	1GP6	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	2C9Z	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F,G,H,I,J,K,L,M,N	2JJ2	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	3BPT	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D,E,F	3CF8	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B	2HCK	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A,B,C,D	1H1I	0.73
QUE	3,5,7,3',4'-PENTAHYDROXYFLAVONE	A	1E8W	0.73
CIO	CILOMILAST	A,B	1XOM	0.71
CIO	CILOMILAST	A,B	1XLX	0.71
SYR	SYRINGATE	A,B	1WB5	0.73
167	6-CARBAMIMIDOYL-2-[2-HYDROXY-5-(3-METHOXY-PHENYL)-INDAN-1-YL]-HEXANOIC ACID	B,I	1QJ6	0.72
NCZ	2-HYDROXY-7-METHOXY-5-METHYL-NAPHTHALENE-1-CARBOXYLIC ACID MESO-2,5-DIHYDROXY-CYCLOPENT-3-ENYL ESTER	A	1J5I	0.81
HZ3	dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate	A,B	2QR9	0.75