Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00517832

Ligand	Ligand name	Chain	PDB	Tanimoto
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	0.78
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXV	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,E	2IBK	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,B,C,D,E,F	2IA6	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1Y9H	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1FYY	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXO	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1DXA	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXL	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,B,D,E,F	1S0M	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1BPS	0.73
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,C	1XC9	0.73
BPJ	(1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	2ROU	0.75
BPJ	(1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	1HX4	0.75
178	4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-2-ISOPROPYLPHENOL	A,B	1TVE	0.75
LYL	2-ALLYL-6-METHYL-PHENOL	A	1OV7	0.78
156	4-[3-OXO-3-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-YL)-PROPENYL]-BENZOIC ACID	A	1FCZ	0.72
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1DL4	0.75
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1I7V	0.75
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1QBY	0.75
PFL	2,6-BIS(1-METHYLETHYL)PHENOL	A,B	1E7A	0.8
OBP		A,B	2DE3	0.73
12M	(2-ETHYLPHENYL)METHANOL	A,B	2F62	0.82
BPI	(1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A,P,T	2I9G	0.75
BPI	(1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	1HWV	0.75
FLP	FLURBIPROFEN	A,B,C,D	3PGH	0.72
FLP	FLURBIPROFEN	A,B	1CQE	0.72
FLP	FLURBIPROFEN	A,B	1EQH	0.72
FLP	FLURBIPROFEN	A,B	2AYL	0.72
FLP	FLURBIPROFEN	A	1DVT	0.72
FLP	FLURBIPROFEN	A	1R9O	0.72
BZR	1S,2R,3S,4R-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1MXJ	0.75
ETY	4-ethylphenol	A,B,C,D	2RA6	0.76
341	(3,5-difluorophenyl)methanol	C	3EON	0.73
B28		A,B	2E9A	0.74
BPM	4-PHOSPHONOOXY-PHENYL-METHYL-[4-PHOSPHONOOXY]BENZEN	A	1AAX	0.72
BPY	BIPHENYL-2,3-DIOL	A	1KMY	0.77
BPY	BIPHENYL-2,3-DIOL	B	1KW8	0.77
BPY	BIPHENYL-2,3-DIOL	A	2EI3	0.77
BPY	BIPHENYL-2,3-DIOL	A	1EIR	0.77
BPY	BIPHENYL-2,3-DIOL	B	1KW6	0.77
BPY	BIPHENYL-2,3-DIOL	B	1KWC	0.77
BPY	BIPHENYL-2,3-DIOL	B	1KW9	0.77
ETC	(R,R)-5,11-CIS-DIETHYL-5,6,11,12-TETRAHYDROCHRYSENE-2,8-DIOL	A,B	1L2I	0.77
ETC	(R,R)-5,11-CIS-DIETHYL-5,6,11,12-TETRAHYDROCHRYSENE-2,8-DIOL	A,B	1L2J	0.77
CRS	M-CRESOL	A,B,C,D	1EV3	0.73
CRS	M-CRESOL	A,B,C,D,E,F	2OMG	0.73
CRS	M-CRESOL	A,B	1UZ9	0.73
CRS	M-CRESOL	A,B,C,D	1ZEH	0.73
CRS	M-CRESOL	A,B,C,D,E,F	1ZEI	0.73
CRS	M-CRESOL	A,C,D,E	7INS	0.73
CRS	M-CRESOL	A,B,C,D,E,G,I,K	1EV6	0.73
LJ1	2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol	A,B	3CN0	0.82
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2E2R	0.82
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2P7G	0.82
24B	(2,4-DIFLUOROPHENYL)METHANOL	A,B	1QV6	0.74
R13	3-METHYL-7-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-YL) -OCTA-2,4,6-TRIENOIC ACID	A	2CBS	0.7
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A,B	2P0M	0.74
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A	1LOX	0.74
RSO	R-STYRENE OXIDE	A,B	1PWZ	0.72
BGG	CARBONIC ACID MONOBENZYL ESTER	B,D	1DLK	0.72
ARL	7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA-2,4,6-TRIENOIC ACID	A	1NQ7	0.71
2LP	2-ALLYLPHENOL	A	1OV5	0.76
ANF	ANTHRONE	H	2BJM	0.73
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	0.71
SS2	(1R)-1-PHENYLETHANOL	A	1ZK0	0.82
SS2	(1R)-1-PHENYLETHANOL	A	1ZJZ	0.82
SS2	(1R)-1-PHENYLETHANOL	A	1ZJY	0.82
BDB		A,B	1KE3	0.72
1OH	4-(1-methyl-1-phenylethyl)phenol	A	2ZAS	0.81
BP3	2'-CHLORO-BIPHENYL-2,3-DIOL	A	1LGT	0.7
DIN	1,6-DIHYDROXY NAPHTHALENE	A	1ZB6	0.74
R12	9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID	A	3CBS	0.72
BP7	1,1'-BIPHENYL-3,4-DIOL	A	2EI0	0.77
EZT	(17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA-1(10),2,4-TRIENE-3,17-DIOL	A,B	2P15	0.72
B08		A,B	2E99	0.75
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.72
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.72
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.72
BPA	7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE	A	1JDG	0.73
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.77
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.77
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.77
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.77
DES	DIETHYLSTILBESTROL	A,B,C,D	1S9P	0.84
DES	DIETHYLSTILBESTROL	A,B	3ERD	0.84
DES	DIETHYLSTILBESTROL	A,B	1TT6	0.84
DES	DIETHYLSTILBESTROL	A,B,C,D	1TZ8	0.84
TBC	(9S,10R)-9-HYDROXY-7,8,9,10-TETRAHYDROBENZO[A]PYRENE	A	1N8C	0.71
IBP	IBUPROFEN	A	3FKX	0.72
IBP	IBUPROFEN	A,B	2BXG	0.72
IBP	IBUPROFEN	A,B	1EQG	0.72
IBP	IBUPROFEN	A,B,C	2WD9	0.72
IBP	IBUPROFEN	A	2PWS	0.72
PPP	3-PHENYL-1,2-PROPANDIOL	A,B	1HRN	0.74
TBT	8,9,10,11-TETRAHYDRO-BENZO[A]ANTHRACENE-8,9,10-TRIOL	A	1DJD	0.75
2PM	N-[2-(BENZHYDRYLOXY)ETHYL]-N,N-DIMETHYLAMINE	A,B	2AOT	0.72
T3O	4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3-OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL	A,B	2G44	0.71
2MP	3,4-DIMETHYLPHENOL	A	1L5O	0.75
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.72
MXN	(2R)-hydroxy(phenyl)ethanenitrile	A,B	3GDN	0.74
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.74
4FC		A	1YSG	0.72
SRL	[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-PHENYL)-1-(DIETHOXY-PHOSPHORYL)-VINYL]-PHOSPHONIC ACID DIETHLYL ESTER	A	1ILH	0.7
SRL	[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-PHENYL)-1-(DIETHOXY-PHOSPHORYL)-VINYL]-PHOSPHONIC ACID DIETHLYL ESTER	A,B	1NRL	0.7
BHQ	2,5-DITERT-BUTYLBENZENE-1,4-DIOL	A,B	2AGV	0.74
269	(1R)-3-chloro-1-phenylpropan-1-ol	A	2RBS	0.75
EPT	HEPTANYL-P-PHENOL	A,B	1AHZ	0.8
FBC		A,B	2B9A	0.72
AED	4-(2-aminoethyl)-2-cyclohexylphenol	A	3BUH	0.7
EST	ESTRADIOL	A,B	1GWR	0.71
EST	ESTRADIOL	A	1FDS	0.71
EST	ESTRADIOL	A,B,C	1G50	0.71
EST	ESTRADIOL	A,B,C,D,E,F	1ERE	0.71
EST	ESTRADIOL	A,B	1A52	0.71
EST	ESTRADIOL	A	1FDT	0.71
EST	ESTRADIOL	A	2OCF	0.71
EST	ESTRADIOL	A,B,C	1QKU	0.71
EST	ESTRADIOL	A,B,C,D,L	1E6W	0.71
EST	ESTRADIOL	A	1IOL	0.71
EST	ESTRADIOL	H	1JNN	0.71
EST	ESTRADIOL	B	1QKT	0.71
EST	ESTRADIOL	A	1FDW	0.71
EST	ESTRADIOL	A,B	1AQU	0.71
EST	ESTRADIOL	A	1LHU	0.71
EST	ESTRADIOL	A	1A27	0.71
EST	ESTRADIOL	L	1JGL	0.71
EST	ESTRADIOL	A,B,E,F	1PCG	0.71
EST	ESTRADIOL	A,B,C,D	1FDU	0.71
EST	ESTRADIOL	A	2J7X	0.71
EST	ESTRADIOL	A,B	2D06	0.71
DFB	2,3-DIFLUOROBENZYL ALCOHOL	A,B	1QV7	0.74
DFB	2,3-DIFLUOROBENZYL ALCOHOL	A,B,C,D	1MG0	0.74
OX1		H,Y	1LO2	0.73
OBZ	O-benzylhydroxylamine	A,B	3DTH	0.72
OBZ	O-benzylhydroxylamine	A,B	3DTG	0.72
4FA	4-FLUOROPHENETHYL ALCOHOL	A	1OWZ	0.72
BPZ	4,4'-cyclohexane-1,1-diyldiphenol	A	2ZKC	0.81
I59	HYDROXY(1-NAPHTHYL)METHYLPHOSPHONIC ACID	A	1O4G	0.75
MCT	4-METHYLCATECHOL	A	1L4G	0.7
MCT	4-METHYLCATECHOL	A	2EHZ	0.7
MCT	4-METHYLCATECHOL	A,B	1DMH	0.7
2NA	naphthalen-2-ylmethanol	A,B,C	3EE5	0.79
1NP	1-NAPHTHOL	X	2ZVQ	0.75
PEL	2-PHENYL-ETHANOL	A,B	1I0D	0.75
PEL	2-PHENYL-ETHANOL	D,H	2I0T	0.75
PEL	2-PHENYL-ETHANOL	A,B	1HZY	0.75
PEL	2-PHENYL-ETHANOL	A,B	1I0B	0.75
PEL	2-PHENYL-ETHANOL	A	1EYW	0.75
PEL	2-PHENYL-ETHANOL	A,B	1JGM	0.75
LJ3	3,5-dibromobiphenyl-4-ol	A,B	3CN2	0.72
EYK	2-tert-butylbenzene-1,4-diol	D,F	3EYM	0.76
EYK	2-tert-butylbenzene-1,4-diol	B	3EYK	0.76
IOB	3-IODO-BENZYL ALCOHOL	A,B	1QK0	0.74
SS1	1-PHENYLETHANOL	H	1UM5	0.82
STL	RESVERATROL	A,B	3CKL	0.72
STL	RESVERATROL	A,B,C,D	1U0W	0.72
STL	RESVERATROL	A	1CGZ	0.72
STL	RESVERATROL	A,B,C,D,E,F,G,H,I,J,K,L,M,N	2JIZ	0.72
STL	RESVERATROL	A	1Z1F	0.72
STL	RESVERATROL	A	1DVS	0.72
STL	RESVERATROL	A,B	1SG0	0.72
IPB	5-METHYL-2-(1-METHYLETHYL)PHENOL	A,B	1E06	0.76
17M	17-METHYL-17-ALPHA-DIHYDROEQUILENIN	A,B	2B1Z	0.73
PCR	P-CRESOL	A	1JHV	0.74
PCR	P-CRESOL	A	1JHU	0.74
PCR	P-CRESOL	A,B,C,D	1DIQ	0.74
MNN	(S)-MANDELIC ACID NITRILE	A	1YB6	0.74
D1N	NAPHTHALENE-1,2-DIOL	A	2EI1	0.72
MBD	3-METHYLCATECHOL	A	1KNF	0.71
TN1	5,6,7,8-TETRAHYDRONAPHTHALEN-1-OL	A	1YSG	0.76
BFL		A,B	1Q4G	0.74
HXS	4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol	A,B	3CV6	0.84
26C		A,B	2F7I	0.72
2HC	(2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID	A,B	1V5Z	0.7
GW5	(2E)-3-{4-[(1E)-1,2-DIPHENYLBUT-1-ENYL]PHENYL}ACRYLIC ACID	A,B,C	1R5K	0.72
NDH	(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-DIHYDRONAPHTHALENE	A,B	1O7P	0.79