Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02548500

Ligand	Ligand name	Chain	PDB	Tanimoto
IPB	5-METHYL-2-(1-METHYLETHYL)PHENOL	A,B	1E06	0.75
DFB	2,3-DIFLUOROBENZYL ALCOHOL	A,B	1QV7	0.8
DFB	2,3-DIFLUOROBENZYL ALCOHOL	A,B,C,D	1MG0	0.8
BPA	7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE	A	1JDG	0.77
EYK	2-tert-butylbenzene-1,4-diol	D,F	3EYM	0.75
EYK	2-tert-butylbenzene-1,4-diol	B	3EYK	0.75
2MP	3,4-DIMETHYLPHENOL	A	1L5O	0.72
BP7	1,1'-BIPHENYL-3,4-DIOL	A	2EI0	0.73
196	3-(3-FLUORO-4-HYDROXYPHENYL)-7-HYDROXY-1-NAPHTHONITRILE	A,B	1YYE	0.7
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.73
OBZ	O-benzylhydroxylamine	A,B	3DTH	0.71
OBZ	O-benzylhydroxylamine	A,B	3DTG	0.71
SRL	[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-PHENYL)-1-(DIETHOXY-PHOSPHORYL)-VINYL]-PHOSPHONIC ACID DIETHLYL ESTER	A	1ILH	0.71
SRL	[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-PHENYL)-1-(DIETHOXY-PHOSPHORYL)-VINYL]-PHOSPHONIC ACID DIETHLYL ESTER	A,B	1NRL	0.71
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	0.75
12M	(2-ETHYLPHENYL)METHANOL	A,B	2F62	0.82
2PM	N-[2-(BENZHYDRYLOXY)ETHYL]-N,N-DIMETHYLAMINE	A,B	2AOT	0.73
EST	ESTRADIOL	A,B	1GWR	0.77
EST	ESTRADIOL	A	1FDS	0.77
EST	ESTRADIOL	A,B,C	1G50	0.77
EST	ESTRADIOL	A,B,C,D,E,F	1ERE	0.77
EST	ESTRADIOL	A,B	1A52	0.77
EST	ESTRADIOL	A	1FDT	0.77
EST	ESTRADIOL	A	2OCF	0.77
EST	ESTRADIOL	A,B,C	1QKU	0.77
EST	ESTRADIOL	A,B,C,D,L	1E6W	0.77
EST	ESTRADIOL	A	1IOL	0.77
EST	ESTRADIOL	H	1JNN	0.77
EST	ESTRADIOL	B	1QKT	0.77
EST	ESTRADIOL	A	1FDW	0.77
EST	ESTRADIOL	A,B	1AQU	0.77
EST	ESTRADIOL	A	1LHU	0.77
EST	ESTRADIOL	A	1A27	0.77
EST	ESTRADIOL	L	1JGL	0.77
EST	ESTRADIOL	A,B,E,F	1PCG	0.77
EST	ESTRADIOL	A,B,C,D	1FDU	0.77
EST	ESTRADIOL	A	2J7X	0.77
EST	ESTRADIOL	A,B	2D06	0.77
RSO	R-STYRENE OXIDE	A,B	1PWZ	0.73
CTL	CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-1-OL	A,B	2AN3	0.73
EED	(9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)-11-(METHOXYMETHYL)ESTRA-1(10),2,4-TRIENE-3,17-DIOL	A,B	2QGT	0.74
4FA	4-FLUOROPHENETHYL ALCOHOL	A	1OWZ	0.79
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
HXS	4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol	A,B	3CV6	0.79
TN1	5,6,7,8-TETRAHYDRONAPHTHALEN-1-OL	A	1YSG	0.73
1OH	4-(1-methyl-1-phenylethyl)phenol	A	2ZAS	0.82
ANF	ANTHRONE	H	2BJM	0.72
EPT	HEPTANYL-P-PHENOL	A,B	1AHZ	0.75
BPY	BIPHENYL-2,3-DIOL	A	1KMY	0.73
BPY	BIPHENYL-2,3-DIOL	B	1KW8	0.73
BPY	BIPHENYL-2,3-DIOL	A	2EI3	0.73
BPY	BIPHENYL-2,3-DIOL	A	1EIR	0.73
BPY	BIPHENYL-2,3-DIOL	B	1KW6	0.73
BPY	BIPHENYL-2,3-DIOL	B	1KWC	0.73
BPY	BIPHENYL-2,3-DIOL	B	1KW9	0.73
ETC	(R,R)-5,11-CIS-DIETHYL-5,6,11,12-TETRAHYDROCHRYSENE-2,8-DIOL	A,B	1L2I	0.73
ETC	(R,R)-5,11-CIS-DIETHYL-5,6,11,12-TETRAHYDROCHRYSENE-2,8-DIOL	A,B	1L2J	0.73
458	4-[(1S,2S,5S)-5-(HYDROXYMETHYL)-8-METHYL-3-OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL	A,B	2B1V	0.71
SS1	1-PHENYLETHANOL	H	1UM5	0.84
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	0.73
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2E2R	0.81
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2P7G	0.81
PPP	3-PHENYL-1,2-PROPANDIOL	A,B	1HRN	0.75
EZT	(17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA-1(10),2,4-TRIENE-3,17-DIOL	A,B	2P15	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	0.73
B28		A,B	2E9A	0.72
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXV	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,E	2IBK	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,B,C,D,E,F	2IA6	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1Y9H	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1FYY	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXO	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1DXA	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXL	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,B,D,E,F	1S0M	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1BPS	0.77
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,C	1XC9	0.77
ENM	(5S,8R,9S,10S,13R,14S,17S)-13-{2-[(3,5-DIFLUOROBENZYL)OXY]ETHYL}-17-HYDROXY-10-METHYLHEXADECAHYDRO-3H-CYCLOPENTA[A]PHENANTHREN-3-ONE	A	2PNU	0.73
TF5	2-[(2',3',4'-TRIFLUOROBIPHENYL-2-YL)OXY]ETHANOL	A,B	2OP3	0.7
TTL	TRANS-(1S,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-1-OL	A,B	2AN5	0.73
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
LYL	2-ALLYL-6-METHYL-PHENOL	A	1OV7	0.74
PEL	2-PHENYL-ETHANOL	A,B	1I0D	0.76
PEL	2-PHENYL-ETHANOL	D,H	2I0T	0.76
PEL	2-PHENYL-ETHANOL	A,B	1HZY	0.76
PEL	2-PHENYL-ETHANOL	A,B	1I0B	0.76
PEL	2-PHENYL-ETHANOL	A	1EYW	0.76
PEL	2-PHENYL-ETHANOL	A,B	1JGM	0.76
FLP	FLURBIPROFEN	A,B,C,D	3PGH	0.73
FLP	FLURBIPROFEN	A,B	1CQE	0.73
FLP	FLURBIPROFEN	A,B	1EQH	0.73
FLP	FLURBIPROFEN	A,B	2AYL	0.73
FLP	FLURBIPROFEN	A	1DVT	0.73
FLP	FLURBIPROFEN	A	1R9O	0.73
L79	(S)-(2E)-3[4-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-2-NAPHTHALENYL)TETRAHYDRO-1-BENZOFURAN-2-YL]-2-PROPENOIC ACID	A,D	1RDT	0.71
RMN	(R)-MANDELIC ACID	A	1MDL	0.71
RMN	(R)-MANDELIC ACID	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	1MCZ	0.71
E3O	(16ALPHA,17ALPHA)-ESTRA-1,3,5(10)-TRIENE-3,16,17-TRIOL	A	2J7Y	0.75
I59	HYDROXY(1-NAPHTHYL)METHYLPHOSPHONIC ACID	A	1O4G	0.74
PFB	2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL	A,B	1MGO	0.72
PFB	2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL	A,B	1HLD	0.72
PFL	2,6-BIS(1-METHYLETHYL)PHENOL	A,B	1E7A	0.75
BPZ	4,4'-cyclohexane-1,1-diyldiphenol	A	2ZKC	0.79
295	(2S,3S)-3-(4-fluorophenyl)-2,3-dihydroxypropanoic acid	A,B	2RJR	0.72
ESL	ESTRIOL	A	1X8V	0.75
FFD	(1R)-1,4-anhydro-2-deoxy-1-(3-fluorophenyl)-5-O-phosphono-D-erythro-pentitol	A,B,C,D,E,F,G,H,I,J,K,L	2PIS	0.71
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	0.72
MNN	(S)-MANDELIC ACID NITRILE	A	1YB6	0.77
24B	(2,4-DIFLUOROPHENYL)METHANOL	A,B	1QV6	0.8
TBT	8,9,10,11-TETRAHYDRO-BENZO[A]ANTHRACENE-8,9,10-TRIOL	A	1DJD	0.79
ETY	4-ethylphenol	A,B,C,D	2RA6	0.72
17M	17-METHYL-17-ALPHA-DIHYDROEQUILENIN	A,B	2B1Z	0.72
B08		A,B	2E99	0.71
BHQ	2,5-DITERT-BUTYLBENZENE-1,4-DIOL	A,B	2AGV	0.75
SMN	(S)-MANDELIC ACID	A	1MDL	0.71
26C		A,B	2F7I	0.74
FL2	FLURBIPROFEN METHYL ESTER	A,B	1HT5	0.71
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
MXN	(2R)-hydroxy(phenyl)ethanenitrile	A,B	3GDN	0.77
1NP	1-NAPHTHOL	X	2ZVQ	0.72
341	(3,5-difluorophenyl)methanol	C	3EON	0.79
TBC	(9S,10R)-9-HYDROXY-7,8,9,10-TETRAHYDROBENZO[A]PYRENE	A	1N8C	0.77
DRQ	(9ALPHA,13BETA,17BETA)-2-[(1Z)-BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE-3,17-DIOL	A,B	2G5O	0.76
SS2	(1R)-1-PHENYLETHANOL	A	1ZK0	0.84
SS2	(1R)-1-PHENYLETHANOL	A	1ZJZ	0.84
SS2	(1R)-1-PHENYLETHANOL	A	1ZJY	0.84
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1DL4	0.79
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1I7V	0.79
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1QBY	0.79
BRB	PARA-BROMOBENZYL ALCOHOL	A,B	1HLD	0.7
FBC		A,B	2B9A	0.74
TON	2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL	A,B	1SEZ	0.71
269	(1R)-3-chloro-1-phenylpropan-1-ol	A	2RBS	0.77
2LP	2-ALLYLPHENOL	A	1OV5	0.72
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	0.72
BPJ	(1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	2ROU	0.79
BPJ	(1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	1HX4	0.79
LJ1	2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol	A,B	3CN0	0.77
BZR	1S,2R,3S,4R-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1MXJ	0.79
ECS	2,3,17BETA-TRIHYDROXY-1,3,5(10)-ESTRATRIENE	A,B,C,D	2BW7	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	0.7
BPI	(1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A,P,T	2I9G	0.79
BPI	(1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	1HWV	0.79
4FC		A	1YSG	0.75
IOB	3-IODO-BENZYL ALCOHOL	A,B	1QK0	0.75
2NA	naphthalen-2-ylmethanol	A,B,C	3EE5	0.83
NDH	(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-DIHYDRONAPHTHALENE	A,B	1O7P	0.79
CRS	M-CRESOL	A,B,C,D	1EV3	0.71
CRS	M-CRESOL	A,B,C,D,E,F	2OMG	0.71
CRS	M-CRESOL	A,B	1UZ9	0.71
CRS	M-CRESOL	A,B,C,D	1ZEH	0.71
CRS	M-CRESOL	A,B,C,D,E,F	1ZEI	0.71
CRS	M-CRESOL	A,C,D,E	7INS	0.71
CRS	M-CRESOL	A,B,C,D,E,G,I,K	1EV6	0.71