Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02792572

Ligand	Ligand name	Chain	PDB	Tanimoto
DFB	2,3-DIFLUOROBENZYL ALCOHOL	A,B	1QV7	0.8
DFB	2,3-DIFLUOROBENZYL ALCOHOL	A,B,C,D	1MG0	0.8
IBP	IBUPROFEN	A	3FKX	0.73
IBP	IBUPROFEN	A,B	2BXG	0.73
IBP	IBUPROFEN	A,B	1EQG	0.73
IBP	IBUPROFEN	A,B,C	2WD9	0.73
IBP	IBUPROFEN	A	2PWS	0.73
EYK	2-tert-butylbenzene-1,4-diol	D,F	3EYM	0.75
EYK	2-tert-butylbenzene-1,4-diol	B	3EYK	0.75
AN1	3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID	H,Y	1LO3	0.71
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
BGG	CARBONIC ACID MONOBENZYL ESTER	B,D	1DLK	0.74
PPT	3-(P-TOLYL)PROPIONIC ACID	A,B	2AY4	0.7
SMN	(S)-MANDELIC ACID	A	1MDL	0.72
PEL	2-PHENYL-ETHANOL	A,B	1I0D	0.82
PEL	2-PHENYL-ETHANOL	D,H	2I0T	0.82
PEL	2-PHENYL-ETHANOL	A,B	1HZY	0.82
PEL	2-PHENYL-ETHANOL	A,B	1I0B	0.82
PEL	2-PHENYL-ETHANOL	A	1EYW	0.82
PEL	2-PHENYL-ETHANOL	A,B	1JGM	0.82
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
MNN	(S)-MANDELIC ACID NITRILE	A	1YB6	0.79
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
DRQ	(9ALPHA,13BETA,17BETA)-2-[(1Z)-BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE-3,17-DIOL	A,B	2G5O	0.75
4FA	4-FLUOROPHENETHYL ALCOHOL	A	1OWZ	0.79
PPP	3-PHENYL-1,2-PROPANDIOL	A,B	1HRN	0.77
I59	HYDROXY(1-NAPHTHYL)METHYLPHOSPHONIC ACID	A	1O4G	0.8
IOB	3-IODO-BENZYL ALCOHOL	A,B	1QK0	0.81
2PM	N-[2-(BENZHYDRYLOXY)ETHYL]-N,N-DIMETHYLAMINE	A,B	2AOT	0.74
LYL	2-ALLYL-6-METHYL-PHENOL	A	1OV7	0.77
184	6-[HYDROXY-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALEN-2-YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCX	0.72
2HS	HEXYLPHOSPHONIC ACID (S)-2-METHYL-3-PHENYLPROPYL ESTER	X	1YS2	0.72
PHQ	FORMIC ACID BENZYL ESTER	A,I	2F4O	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1KJO	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2CDR	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2C1E	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	5PAD	0.72
PHQ	FORMIC ACID BENZYL ESTER	E,F	1JXQ	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	2CNO	0.72
PHQ	FORMIC ACID BENZYL ESTER	A,B	1CGL	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ9	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2C2K	0.72
PHQ	FORMIC ACID BENZYL ESTER	A,I	2CNL	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1KJP	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2C2M	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2AZB	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	9HVP	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1ESB	0.72
PHQ	FORMIC ACID BENZYL ESTER	E,F	1DY8	0.72
PHQ	FORMIC ACID BENZYL ESTER	E,I	1PPM	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	1GEC	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1KS7	0.72
PHQ	FORMIC ACID BENZYL ESTER	C	1A8G	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1KKK	0.72
PHQ	FORMIC ACID BENZYL ESTER	T,U,V,W,X,Y	1QDU	0.72
PHQ	FORMIC ACID BENZYL ESTER	E,I	4TMN	0.72
PHQ	FORMIC ACID BENZYL ESTER	E,I	5TMN	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1KTO	0.72
PHQ	FORMIC ACID BENZYL ESTER	A,C	1TG1	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ8	0.72
PHQ	FORMIC ACID BENZYL ESTER	A,B	2G58	0.72
PHQ	FORMIC ACID BENZYL ESTER	Q,R,S,T,U,V	1F9E	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2CJY	0.72
PHQ	FORMIC ACID BENZYL ESTER	A,I	1E8M	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1KR6	0.72
PHQ	FORMIC ACID BENZYL ESTER	E,I	6TMN	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1KRO	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2CNN	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2C2O	0.72
PHQ	FORMIC ACID BENZYL ESTER	A,B	1SQZ	0.72
PHQ	FORMIC ACID BENZYL ESTER	A,B	1THE	0.72
PHQ	FORMIC ACID BENZYL ESTER	I,J	2AZC	0.72
PHQ	FORMIC ACID BENZYL ESTER	E,I	5EST	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	2CNK	0.72
PHQ	FORMIC ACID BENZYL ESTER	A	1KL6	0.72
PHQ	FORMIC ACID BENZYL ESTER	I	6PAD	0.72
PHQ	FORMIC ACID BENZYL ESTER	B,I	2C2Z	0.72
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
RSO	R-STYRENE OXIDE	A,B	1PWZ	0.75
1OH	4-(1-methyl-1-phenylethyl)phenol	A	2ZAS	0.82
2HR	HEXYLPHOSPHONIC ACID (R)-2-METHYL-3-PHENYLPROPYL ESTER	X	1YS1	0.72
SS2	(1R)-1-PHENYLETHANOL	A	1ZK0	0.87
SS2	(1R)-1-PHENYLETHANOL	A	1ZJZ	0.87
SS2	(1R)-1-PHENYLETHANOL	A	1ZJY	0.87
TTB	4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID	A	1XAP	0.74
CTL	CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-1-OL	A,B	2AN3	0.75
OBP		A,B	2DE3	0.7
ECS	2,3,17BETA-TRIHYDROXY-1,3,5(10)-ESTRATRIENE	A,B,C,D	2BW7	0.71
DIN	1,6-DIHYDROXY NAPHTHALENE	A	1ZB6	0.73
TBC	(9S,10R)-9-HYDROXY-7,8,9,10-TETRAHYDROBENZO[A]PYRENE	A	1N8C	0.79
LJ1	2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol	A,B	3CN0	0.81
ANF	ANTHRONE	H	2BJM	0.75
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2E2R	0.81
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2P7G	0.81
MBD	3-METHYLCATECHOL	A	1KNF	0.7
MXN	(2R)-hydroxy(phenyl)ethanenitrile	A,B	3GDN	0.79
B28		A,B	2E9A	0.77
PFL	2,6-BIS(1-METHYLETHYL)PHENOL	A,B	1E7A	0.79
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
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	0.71
D1N	NAPHTHALENE-1,2-DIOL	A	2EI1	0.71
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.72
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.72
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.72
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.72
EED	(9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)-11-(METHOXYMETHYL)ESTRA-1(10),2,4-TRIENE-3,17-DIOL	A,B	2QGT	0.72
EST	ESTRADIOL	A,B	1GWR	0.75
EST	ESTRADIOL	A	1FDS	0.75
EST	ESTRADIOL	A,B,C	1G50	0.75
EST	ESTRADIOL	A,B,C,D,E,F	1ERE	0.75
EST	ESTRADIOL	A,B	1A52	0.75
EST	ESTRADIOL	A	1FDT	0.75
EST	ESTRADIOL	A	2OCF	0.75
EST	ESTRADIOL	A,B,C	1QKU	0.75
EST	ESTRADIOL	A,B,C,D,L	1E6W	0.75
EST	ESTRADIOL	A	1IOL	0.75
EST	ESTRADIOL	H	1JNN	0.75
EST	ESTRADIOL	B	1QKT	0.75
EST	ESTRADIOL	A	1FDW	0.75
EST	ESTRADIOL	A,B	1AQU	0.75
EST	ESTRADIOL	A	1LHU	0.75
EST	ESTRADIOL	A	1A27	0.75
EST	ESTRADIOL	L	1JGL	0.75
EST	ESTRADIOL	A,B,E,F	1PCG	0.75
EST	ESTRADIOL	A,B,C,D	1FDU	0.75
EST	ESTRADIOL	A	2J7X	0.75
EST	ESTRADIOL	A,B	2D06	0.75
1NP	1-NAPHTHOL	X	2ZVQ	0.76
STL	RESVERATROL	A,B	3CKL	0.71
STL	RESVERATROL	A,B,C,D	1U0W	0.71
STL	RESVERATROL	A	1CGZ	0.71
STL	RESVERATROL	A,B,C,D,E,F,G,H,I,J,K,L,M,N	2JIZ	0.71
STL	RESVERATROL	A	1Z1F	0.71
STL	RESVERATROL	A	1DVS	0.71
STL	RESVERATROL	A,B	1SG0	0.71
269	(1R)-3-chloro-1-phenylpropan-1-ol	A	2RBS	0.79
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
EPT	HEPTANYL-P-PHENOL	A,B	1AHZ	0.78
HXS	4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol	A,B	3CV6	0.83
178	4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-2-ISOPROPYLPHENOL	A,B	1TVE	0.72
TTL	TRANS-(1S,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-1-OL	A,B	2AN5	0.75
OX1		H,Y	1LO2	0.71
BPI	(1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A,P,T	2I9G	0.8
BPI	(1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	1HWV	0.8
BZR	1S,2R,3S,4R-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1MXJ	0.8
DES	DIETHYLSTILBESTROL	A,B,C,D	1S9P	0.81
DES	DIETHYLSTILBESTROL	A,B	3ERD	0.81
DES	DIETHYLSTILBESTROL	A,B	1TT6	0.81
DES	DIETHYLSTILBESTROL	A,B,C,D	1TZ8	0.81
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
2DM	2-HYDROXY-3-(PYREN-1-YLMETHOXY)PROPYL DIHYDROGEN PHOSPHATE	A,B	1S88	0.71
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1DL4	0.8
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1I7V	0.8
BZA	1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL	A	1QBY	0.8
BPY	BIPHENYL-2,3-DIOL	A	1KMY	0.76
BPY	BIPHENYL-2,3-DIOL	B	1KW8	0.76
BPY	BIPHENYL-2,3-DIOL	A	2EI3	0.76
BPY	BIPHENYL-2,3-DIOL	A	1EIR	0.76
BPY	BIPHENYL-2,3-DIOL	B	1KW6	0.76
BPY	BIPHENYL-2,3-DIOL	B	1KWC	0.76
BPY	BIPHENYL-2,3-DIOL	B	1KW9	0.76
ETC	(R,R)-5,11-CIS-DIETHYL-5,6,11,12-TETRAHYDROCHRYSENE-2,8-DIOL	A,B	1L2I	0.76
ETC	(R,R)-5,11-CIS-DIETHYL-5,6,11,12-TETRAHYDROCHRYSENE-2,8-DIOL	A,B	1L2J	0.76
GW5	(2E)-3-{4-[(1E)-1,2-DIPHENYLBUT-1-ENYL]PHENYL}ACRYLIC ACID	A,B,C	1R5K	0.73
ESL	ESTRIOL	A	1X8V	0.73
24B	(2,4-DIFLUOROPHENYL)METHANOL	A,B	1QV6	0.8
BPJ	(1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	2ROU	0.8
BPJ	(1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE-2,3,4-TRIOL	A	1HX4	0.8
E3O	(16ALPHA,17ALPHA)-ESTRA-1,3,5(10)-TRIENE-3,16,17-TRIOL	A	2J7Y	0.73
2LP	2-ALLYLPHENOL	A	1OV5	0.75
BPA	7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE	A	1JDG	0.79
4BZ	4-(HYDROXYMETHYL)BENZAMIDINE	A	1S6H	0.71
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.73
NDH	(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-DIHYDRONAPHTHALENE	A,B	1O7P	0.82
17M	17-METHYL-17-ALPHA-DIHYDROEQUILENIN	A,B	2B1Z	0.72
NDD	2,6-DICARBOXYNAPHTHALENE	A	1U4O	0.72
NDD	2,6-DICARBOXYNAPHTHALENE	A,B,C,D	1HAC	0.72
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	0.7
BRB	PARA-BROMOBENZYL ALCOHOL	A,B	1HLD	0.75
OBZ	O-benzylhydroxylamine	A,B	3DTH	0.77
OBZ	O-benzylhydroxylamine	A,B	3DTG	0.77
BHQ	2,5-DITERT-BUTYLBENZENE-1,4-DIOL	A,B	2AGV	0.75
B08		A,B	2E99	0.76
SS1	1-PHENYLETHANOL	H	1UM5	0.87
2MP	3,4-DIMETHYLPHENOL	A	1L5O	0.76
12M	(2-ETHYLPHENYL)METHANOL	A,B	2F62	0.89
26C		A,B	2F7I	0.74
FL2	FLURBIPROFEN METHYL ESTER	A,B	1HT5	0.71
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	0.71
RMN	(R)-MANDELIC ACID	A	1MDL	0.72
RMN	(R)-MANDELIC ACID	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	1MCZ	0.72
LJ3	3,5-dibromobiphenyl-4-ol	A,B	3CN2	0.72
NLA	NAPHTHALEN-1-YL-ACETIC ACID	A,B,C,D	1LRH	0.7
NLA	NAPHTHALEN-1-YL-ACETIC ACID	B	2P1O	0.7
2NA	naphthalen-2-ylmethanol	A,B,C	3EE5	0.9
T3O	4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3-OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL	A,B	2G44	0.72
ETY	4-ethylphenol	A,B,C,D	2RA6	0.75
341	(3,5-difluorophenyl)methanol	C	3EON	0.79
COR	2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANE	A	9HVP	0.71
R12	9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID	A	3CBS	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.71
BFL		A,B	1Q4G	0.75
BP7	1,1'-BIPHENYL-3,4-DIOL	A	2EI0	0.76
BDB		A,B	1KE3	0.71
PCR	P-CRESOL	A	1JHV	0.73
PCR	P-CRESOL	A	1JHU	0.73
PCR	P-CRESOL	A,B,C,D	1DIQ	0.73
FBC		A,B	2B9A	0.74
TBT	8,9,10,11-TETRAHYDRO-BENZO[A]ANTHRACENE-8,9,10-TRIOL	A	1DJD	0.8
TON	2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL	A,B	1SEZ	0.71
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.72
TN1	5,6,7,8-TETRAHYDRONAPHTHALEN-1-OL	A	1YSG	0.76
IPB	5-METHYL-2-(1-METHYLETHYL)PHENOL	A,B	1E06	0.79
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
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXV	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,E	2IBK	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,B,C,D,E,F	2IA6	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1Y9H	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1FYY	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXO	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1DXA	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1AXL	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,B,D,E,F	1S0M	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A	1BPS	0.79
BAP	1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE	A,C	1XC9	0.79
4FC		A	1YSG	0.75
CIN	4-CARBOXYCINNAMIC ACID	A,B,C,D	1HAB	0.7
CIN	4-CARBOXYCINNAMIC ACID	A,B	1T6J	0.7
BPZ	4,4'-cyclohexane-1,1-diyldiphenol	A	2ZKC	0.8