Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01455071

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
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.74
DDC	7-HYDROXY-2-PHENYL-CHROMAN-4-ONE	A,B	1FM8	0.76
JUG	5-hydroxynaphthalene-1,4-dione	A,B,C,D,E,F	3B7J	0.76
OHP	(2-HYDROXYPHENYL)ACETIC ACID	A	2INZ	0.71
FLN	2-PHENYL-4H-CHROMEN-4-ONE	A	2G0L	0.74
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1DOD	0.74
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1DOE	0.74
DOB	2,4-DIHYDROXYBENZOIC ACID	A	1PBB	0.74
HMO	4'-HYDROXY-7-METHOXYISOFLAVONE	A	1FP2	0.8
PSN	BENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE	A	1O4K	0.72
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
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A	2Z9C	0.72
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A,B	1OOQ	0.72
DTC	BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2-BENZOPYRONE]	A,B,C,D,E,F,G,H	2F1O	0.72
NOM	7-HYDROXY-5-METHYL-3,3A,5,11B-TETRAHYDRO-1,4-DIOXA-CYCLOPENTA[A]ANTHRACENE-2,6,11-TRIONE	A	1N5V	0.79
RUT	RUTIN	A,B	1RY8	0.71
M1S	(5E)-14-CHLORO-15,17-DIHYDROXY-4,7,8,9,10,11-HEXAHYDRO-2-BENZOXACYCLOPENTADECINE-1,12(3H,13H)-DIONE	A	2IWX	0.76
3HB	3-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCB	0.72
3HB	3-HYDROXYBENZOIC ACID	A	2DKH	0.72
DRA	11-DEOXY-BETA-RHODOMYCIN	A,B	1XDS	0.7
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	0.82
8MO	METHOXSALEN	A,B,C,D	1Z11	0.71
SDN	[(3S)-9-hydroxy-1-methyl-10-oxo-4,10-dihydro-3H-benzo[g]isochromen-3-yl]acetic acid	A,B	3B6C	0.82
U01	3-[1-(4-BROMO-PHENYL)-2-METHYL-PROPYL]-4-HYDROXY-CHROMEN-2-ONE	A	1UPJ	0.72
HZ3	dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate	A,B	2QR9	0.81
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A,B	1I7I	0.72
AZ2	(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID	A	1I7G	0.72
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)-2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.72
SAL	2-HYDROXYBENZOIC ACID	A	2I2Z	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B,C	1FIQ	0.78
SAL	2-HYDROXYBENZOIC ACID	A	2I30	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B	1PTH	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B	3DEU	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B,C,D	2E1Q	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B	3HGX	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B	3BPX	0.78
SAL	2-HYDROXYBENZOIC ACID	A	1WYG	0.78
SAL	2-HYDROXYBENZOIC ACID	A	1JGS	0.78
SAL	2-HYDROXYBENZOIC ACID	X	1M6E	0.78
SAL	2-HYDROXYBENZOIC ACID	A	3B9M	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B	1FO4	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B	1Y7I	0.78
SAL	2-HYDROXYBENZOIC ACID	A,B	2FN1	0.78
YZ9	7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER	A,B,C	1GCZ	0.71
AKY		A,B,C,D	2IPI	0.71
WRR	4-HYDROXY-3-[(1S,3R)-3-HYDROXY-1-PHENYLBUTYL]-2H-CHROMEN-2-ONE	A	1H9Z	0.75
NAR	NARINGENIN	A,B	2UXU	0.76
NAR	NARINGENIN	A	2BRT	0.76
NAR	NARINGENIN	A	1CGK	0.76
NAR	NARINGENIN	A,B	1EYQ	0.76
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.73
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.73
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.73
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.73
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.73
WRS	4-HYDROXY-3-[(1S,3S)-3-HYDROXY-1-PHENYLBUTYL]-2H-CHROMEN-2-ONE	A	1HA2	0.75
3CA		A,B	2B77	0.77
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B	2TPL	0.7
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B,C,D	3GGP	0.7
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
GRE	2,6-DIHYDROXYBENZOIC ACID	A,B,C,D	2DVU	0.75
7CA	5,7-DIHYDROXY-2-(4-METHOXYPHENYL)-8-(3-METHYLBUTYL)-4-OXO-4H-CHROMEN-3-YL 6-DEOXY-ALPHA-L-MANNOPYRANOSIDE	A	2H44	0.74
HHH	(2S)-hydroxy(4-hydroxyphenyl)ethanoic acid	A,B	2R5V	0.71
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
MYU	3,5,6,7-TETRAHYDROXY-2-(3,4-DIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O64	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PIT	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ1	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PIU	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2PKL	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A,B	3D57	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ2	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	2QPY	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NQ0	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A	1NUO	0.71
4HY	[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID	A,B	2PIN	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	1D83	0.82
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B	1EKH	0.82
CPH	1,8-DIHYDROXY-7-METHYL-3-(1,3,4-TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-2H-ANTHRACEN-9-ONE	A,B	1EKI	0.82
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	0.82
1NH	(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]-3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE	B	1O1S	0.74
NP5	(5E)-12-CHLORO-13,15-DIHYDROXY-4,7,8,9-TETRAHYDRO-2-BENZOXACYCLOTRIDECINE-1,10(3H,11H)-DIONE	A	2IWU	0.76
2HI	(2S,3R)-2,7-DIHYDROXY-3-(4-HYDROXYPHENYL)-2,3-DIHYDRO-4H-CHROMEN-4-ONE	A	1ZG3	0.76
UIN	5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN-2-ONE	B	5UPJ	0.7
U03	4-HYDROXY-7-METHOXY-3-(1-PHENYL-PROPYL)-CHROMEN-2-ONE	A	3UPJ	0.75
DM4	1-O-DEMETHYL-6-DEOXYDOXORUBICIN	A	1D37	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	0.72
44D	7-[5-(4-AMINO-5-HYDROXY-6-METHYL-TETRAHYDRO-PYRAN-2-YLOXY)-4-HYDROXY-6-METHYL-TETRAHYDRO-PYRAN-2-YLOXY]-6,9,11-TRIHYDROXY-9-(2-HYDROXY-ACETYL)-7,8,9,10-TETRAHYDRO-NAPHTHACENE-5,12-DIONE	A,B	1NAB	0.71
LY2	2-MORPHOLIN-4-YL-7-PHENYL-4H-CHROMEN-4-ONE	A	1YI3	0.7
LY2	2-MORPHOLIN-4-YL-7-PHENYL-4H-CHROMEN-4-ONE	A	1E7V	0.7
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.71
BHF	2-PHENYL-4H-BENZO[H]CHROMEN-4-ONE	A	2HI4	0.75
564	6-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALENE-2-CARBONYL)-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCY	0.74
DIU	2-HYDROXY-3,5-DIIODO-BENZOIC ACID	A,B	3B56	0.75
DIU	2-HYDROXY-3,5-DIIODO-BENZOIC ACID	A	2BXL	0.75
R12	9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID	A	3CBS	0.72
DM3	6-DEOXYDAUNOMYCIN	A	1D14	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	0.77
FHI		A,B	1Y1D	0.8
OAC	TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE	C	3GCH	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	0.81
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	0.81
AKV	{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE	A,B,C,D	2F99	0.84
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
RDC	RADICICOL	A,B	2Q8I	0.75
RDC	RADICICOL	A,B	1U0Z	0.75
RDC	RADICICOL	A	1BGQ	0.75
RDC	RADICICOL	B,D,F,H	2ZBK	0.75
RDC	RADICICOL	A	2HKJ	0.75
RDC	RADICICOL	A,B,C	3CGY	0.75
RDC	RADICICOL	A,B	2WER	0.75
EQU	EQUILENIN	A,B	1OGX	0.7
EQU	EQUILENIN	A,B,C,D,E,F	1QJG	0.7
EQU	EQUILENIN	A,B	1OH0	0.7
EQU	EQUILENIN	A	1W6Y	0.7
EQU	EQUILENIN	A,B	1CQS	0.7
EQU	EQUILENIN	A	1OGZ	0.7
EQU	EQUILENIN	A	1GS3	0.7
EQU	EQUILENIN	A	1OHO	0.7
MYF	5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2O65	0.71
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.76
184	6-[HYDROXY-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALEN-2-YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCX	0.74
TOH	(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IME	0.73
TOH	(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IMD	0.73
QSO	5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one	A,B	2QYO	0.8
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.71
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.71
299	2,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATE	A	1O4E	0.71
AC6	P-HYDROXYACETOPHENONE	A	2GQ8	0.72
AC6	P-HYDROXYACETOPHENONE	X	2O48	0.72
RWF	R-WARFARIN	A,B	2BXD	0.77
TOM	4-(2-METHOXYPHENYL)-2-OXOBUT-3-ENOIC ACID	A	2IMF	0.74
ZCT		A,B,C,D,E,F,G,H	3B6A	0.8
219	CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE	A	1O4I	0.72
DM7	4'-DEOXY-4'-IODODOXORUBICIN	A	1IMR	0.71
DM7	4'-DEOXY-4'-IODODOXORUBICIN	A	1IMS	0.71
ORE	4-(2,7-DIFLUORO-6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)ISOPHTHALIC ACID	H,I	2A9N	0.77
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	B,C	1JX1	0.77
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1JX0	0.77
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1FM7	0.77
34D	3,5-DIHYDROXYBENZOATE	A,B	2BX7	0.71
MUF	(8alpha,10alpha,13alpha,17beta)-17-[(4-hydroxyphenyl)carbonyl]androsta-3,5-diene-3-carboxylic acid	A,B	3BEJ	0.73
AKT	10-DECARBOXYMETHYLACLACINOMYCIN T (DCMAT)	A	1Q0R	0.7
NOA	NAPHTHYLOXYACETIC ACID	A,B,I	1HIV	0.7
NOA	NAPHTHYLOXYACETIC ACID	I	1IVP	0.7
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	3CMP	0.75
DBH	2,3-DIHYDROXY-BENZOIC ACID	A	1MD9	0.75
DBH	2,3-DIHYDROXY-BENZOIC ACID	A	1MDB	0.75
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	1L6M	0.75
DBH	2,3-DIHYDROXY-BENZOIC ACID	A,B,C	3BY0	0.75
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	0.81
ERD	(2S)-2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE	D,F	2NNL	0.73
DM5	IDARUBICIN	A,B,D	198D	0.72
DM5	IDARUBICIN	A	1D38	0.72
DM5	IDARUBICIN	A	1D67	0.72
GRR	(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid	A	3CDS	0.75
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3B3K	0.75
LRG	(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid	A	3D6D	0.75
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	0.75
26C		A,B	2F7I	0.73
4HP	4-HYDROXYPHENYLACETATE	A,B,C,D	2JBT	0.71
4HP	4-HYDROXYPHENYLACETATE	A	2YYJ	0.71
4HP	4-HYDROXYPHENYLACETATE	A	2YYM	0.71
4HP	4-HYDROXYPHENYLACETATE	B	1AI6	0.71
4HP	4-HYDROXYPHENYLACETATE	M,N,O,P,Q,R	3PCG	0.71
FDS	FLUORESCIN	H	4FAB	0.77
NIU	6,7,8,9-TETRAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN-2-ONE	A	6UPJ	0.7
DFL	2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE	A,B	1JEP	0.77
OAL	(1,8-DIHYDROXY-9,10-DIOXO-9,10-DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID	B	1N5T	0.82
NGV	METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11-TRIOXO-3,4,6,11-TETRAHYDROTETRACENE-1-CARBOXYLATE	A,B,C,D	2F98	0.81
NGV	METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11-TRIOXO-3,4,6,11-TETRAHYDROTETRACENE-1-CARBOXYLATE	A	1SJW	0.81
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.75
L41	{4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid	A,B	3D5F	0.83
A04	5-[2-(TRIFLUOROMETHOXY)PHENYL]-2-FUROIC ACID	A	2Q94	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
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.76
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.76
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A,B	1FHY	0.74
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	B	204D	0.74
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A,B	2B2B	0.74
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	B	1FHZ	0.74
PSO	4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN	A	203D	0.74
T4A		C,D	1KGI	0.7
T4A		A,B	1Z7J	0.7
TBH	5-(2-{2-[(TERT-BUTOXY-HYDROXY-METHYL)-AMINO]-1-HYDROXY-3-PHENYL-PROPYLAMINO}-3-HYDROXY-3-PENTYLAMINO-PROPYL)-2-CARBOXYMETHOXY-BENZOIC ACID	B	1JF7	0.7
HXP	3,6-DIHYDROXY-XANTHENE-9-PROPIONIC ACID	A	1XAN	0.73
NCZ	2-HYDROXY-7-METHOXY-5-METHYL-NAPHTHALENE-1-CARBOXYLIC ACID MESO-2,5-DIHYDROXY-CYCLOPENT-3-ENYL ESTER	A	1J5I	0.8
SWF	S-WARFARIN	A,B	1OG5	0.77
789	3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)-1H-INDEN-1-ONE	A,B	1ZAF	0.72
AKA	10-DECARBOXYMETHYLACLACINOMYCIN A (DCMAA)	A	1Q0Z	0.7
FSE	3,7,3',4'-TETRAHYDROXYFLAVONE	B	1XO2	0.74
2PB	2-[(DIOXIDOPHOSPHINO)OXY]BENZOATE	A	1SDE	0.71
DBA	(2,6-DIMETHYL-PHENOXY)-ACETIC ACID	A,B	1IDB	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	0.81
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.76
PHB	P-HYDROXYBENZOIC ACID	A	1CJ4	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1DOB	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PXB	0.7
PHB	P-HYDROXYBENZOIC ACID	A,B	1G1B	0.7
PHB	P-HYDROXYBENZOIC ACID	A,B	1YKJ	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1IUV	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PBE	0.7
PHB	P-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCC	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PDH	0.7
PHB	P-HYDROXYBENZOIC ACID	B	2BUW	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1CC4	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1CC6	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1IUW	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1FW9	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1G81	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1BGJ	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1IUX	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1CJ3	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1D7L	0.7
PHB	P-HYDROXYBENZOIC ACID	A	2PHH	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1BGN	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PXA	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1DOC	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1K0I	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1BKW	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1JD3	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1PXC	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1TT8	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1CJ2	0.7
PHB	P-HYDROXYBENZOIC ACID	A,B	1Q4S	0.7
PHB	P-HYDROXYBENZOIC ACID	A	1BF3	0.7
PHB	P-HYDROXYBENZOIC ACID	B	2BUR	0.7
HCC	2',4,4'-TRIHYDROXYCHALCONE	D	1FP1	0.77
NP4	(5Z)-12-CHLORO-13,15-DIHYDROXY-4,7,8,9-TETRAHYDRO-2-BENZOXACYCLOTRIDECINE-1,10(3H,11H)-DIONE	A	2IWS	0.76
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	0.76
OEF	3,5-DIBROMO-4-(3-ISOPROPYL-PHENOXY)BENZOIC ACID	A	2J4A	0.7
OFF	2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]-L-THREO-PENTARIC ACID	A	2OFF	0.77
ADL	(1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID	A,B	1N5S	0.81
B21	5-(2-METHOXYPHENYL)-2-FUROIC ACID	A	2Q93	0.79
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	0.76
SIG	STIGMATELLIN	C,D,E	2BCC	0.72
SIG	STIGMATELLIN	C,D,E	3BCC	0.72
DM1	DAUNOMYCIN	A	152D	0.7
DM1	DAUNOMYCIN	A,B,C,D	1O0K	0.7
DM1	DAUNOMYCIN	A	1JO2	0.7
DM1	DAUNOMYCIN	A,B	308D	0.7
DM1	DAUNOMYCIN	A	1D33	0.7
DM1	DAUNOMYCIN	A	110D	0.7
DM1	DAUNOMYCIN	A	1D11	0.7
DM1	DAUNOMYCIN	A	427D	0.7
DM1	DAUNOMYCIN	A	2D34	0.7
DM1	DAUNOMYCIN	A	3F8F	0.7
DM1	DAUNOMYCIN	A	1D10	0.7
DM1	DAUNOMYCIN	A	1DA0	0.7
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A,B	2RH4	0.78
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A,B	3CSD	0.78
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A,B	2RHR	0.78
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A	1F0Q	0.78
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A	3C13	0.78
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A,B	2RHC	0.78
EMO	3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE	A	3BQC	0.78
FBC		A,B	2B9A	0.73
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
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2QZZ	0.72
EMF	ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate	A,B	2R2G	0.72
MOA	MYCOPHENOLIC ACID	A	1ME7	0.79
MOA	MYCOPHENOLIC ACID	A,B	1JR1	0.79
MOA	MYCOPHENOLIC ACID	A	1MEI	0.79
MOA	MYCOPHENOLIC ACID	A	1MEH	0.79
SAK	(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-4H-chromen-4-one	A,B,C,D,E,F	3D04	0.77
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
MAX	MATAIRESINOL	A	2BGM	0.74
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.75
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.75
G24	[4-(3-BENZYL-4-HYDROXYBENZYL)-3,5-DIMETHYLPHENOXY]ACETIC ACID	A	1Q4X	0.76
4FC		A	1YSG	0.73
DBF	DIBENZOFURAN-4,6-DICARBOXYLIC ACID	B	1DVU	0.78
P2N	(5Z)-13-CHLORO-14,16-DIHYDROXY-3,4,7,8,9,10-HEXAHYDRO-1H-2-BENZOXACYCLOTETRADECINE-1,11(12H)-DIONE	A	2CGF	0.76
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	0.78
FLV	FLAVIOLIN	A	1ZDW	0.75
FLV	FLAVIOLIN	A	1T93	0.75
FLV	FLAVIOLIN	A	2D09	0.75
VII	2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID	A,B	2GFK	0.79
DM6	4'-EPIDOXORUBICIN	A	1D15	0.7
DM6	4'-EPIDOXORUBICIN	A	1D54	0.7
DM6	4'-EPIDOXORUBICIN	A	1D58	0.7
DM6	4'-EPIDOXORUBICIN	A	1QDA	0.7
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
DM2	DOXORUBICIN	A	2DR6	0.7
DM2	DOXORUBICIN	A	1P20	0.7
DM2	DOXORUBICIN	A	1I1E	0.7
DM2	DOXORUBICIN	A	151D	0.7
DM2	DOXORUBICIN	A	1D12	0.7
DM2	DOXORUBICIN	A	1DA9	0.7
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
BJH	1(R)-1-ACETAMIDO-2-(3-CARBOXY-2-HYDROXYPHENYL)ETHYL BORONIC ACID	A	1ERQ	0.71
DBE	bis(4-hydroxyphenyl)methanone	A	2VKU	0.75
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5A	0.84
BIK	3,7-DIHYDROXY-2-NAPHTHOIC ACID	A	1U5C	0.84
GEN	GENISTEIN	A	1QKM	0.78
GEN	GENISTEIN	A,B	1X7J	0.78
GEN	GENISTEIN	A,B	2QA8	0.78
GEN	GENISTEIN	A	1X7R	0.78
KMP	3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE	A,B,C,D	1H1M	0.75
KMP	3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE	A	2C1Z	0.75
FC3	5-[2-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID	A	2EVC	0.71
DZN	DAIDZIN	A,B,C,D,E,F,G,H	2VLE	0.73
MGI	methyl 4-(2,3-dihydroxy-5-methylphenoxy)-2-hydroxy-6-methylbenzoate	A	2ZA0	0.78
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID	A,B	2BXE	0.82
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID	A,B	3D2T	0.82
AGI	5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one	A,B,C,D,E,F	3CF9	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	0.7
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
OSB	2-SUCCINYLBENZOATE	A	1FHV	0.74
OSB	2-SUCCINYLBENZOATE	A,B,C,D	1SJB	0.74
OSB	2-SUCCINYLBENZOATE	A,B	2QVH	0.74
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	L	1FLR	0.78
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A,B	1N0S	0.78
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	C,L	1T66	0.78
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A	1X9Q	0.78
FLU	2-(6-HYDROXY-3-OXO-3H-XANTHEN-9-YL)-BENZOIC ACID	A,D	2NMV	0.78
23A	2,3-DIHYDROXYBENZALDEHYDE	A,B,C,D	2DVX	0.71
C1F	3-CARBOXY-4-METHYL-5-PROPYL-2-FURANPROPIONIC	A,B	2BXA	0.71
G50	3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN-1-ONE	A,B	2UXI	0.77
INX	2-(CARBOXYMETHOXY)-5-[(2S)-2-({(2S)-2-[(3-CARBOXYPROPANOYL)AMINO] -3-PHENYLPROPANOYL}AMINO)-3-OXO-3-(PENTYLAMINO)PROPYL]BENZOIC ACID	A	1G7G	0.7