Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00018681

Ligand	Ligand name	Chain	PDB	Tanimoto
HZH	1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan-2-one	A,B	3DEA	0.79
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.76
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.76
HY1	PHENYLACETALDEHYDE	D,H	2I0S	0.73
HY1	PHENYLACETALDEHYDE	A,B	1D6Y	0.73
HY1	PHENYLACETALDEHYDE	A,B	1D6Z	0.73
HY1	PHENYLACETALDEHYDE	D,H	2OK4	0.73
HY1	PHENYLACETALDEHYDE	A,B	1D6U	0.73
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.72
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.72
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.72
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.72
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.76
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.76
2HT	3-methylbenzonitrile	A,B	3F88	0.74
OXE	ORTHO-XYLENE	A,B	3E0X	0.85
OXE	ORTHO-XYLENE	A	188L	0.85
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.72
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.72
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.72
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.72
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.72
787	(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACID	A	1O4R	0.72
BT6	benzenethiol	A,B,C,D	3HSR	0.76
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.83
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.75
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.75
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.75
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.75
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.75
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.75
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.75
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.75
SEH	S-BENZYL PHENYLACETOTHIOHYDROXIMATE-O-SULFATE	M	1W9D	0.73
MAJ	indane-5-sulfonamide	A	2QOA	0.7
PYL	PHENYLETHANE	C	1B07	0.88
PYL	PHENYLETHANE	A,B	2VRM	0.88
PYL	PHENYLETHANE	A	1NHB	0.88
MBN	TOLUENE	A,B	3D7O	0.85
MBN	TOLUENE	A,B	1R1X	0.85
MBN	TOLUENE	A,B	1JLX	0.85
MBN	TOLUENE	A,B,C,D	3D17	0.85
MBN	TOLUENE	A,B	2VRL	0.85
MBN	TOLUENE	A,I	2Z3E	0.85
MBN	TOLUENE	A,B	1YZI	0.85
MBN	TOLUENE	A,B	2DN1	0.85
MBN	TOLUENE	A,B	3EN1	0.85
PXY	PARA-XYLENE	A	187L	0.85
PXY	PARA-XYLENE	A	225L	0.85
MFG	(1Z)-4-(4-FLUOROPHENYL)-2-METHYLIDENEBUTAN-1-IMINE	A,B	2VZ2	0.72
BTP	2-THIOMETHYL-3-PHENYLPROPANOIC ACID	A,B	1JAO	0.72
BDB		A,B	1KE3	0.78
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOJ	0.72
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOL	0.72
NPY	NAPHTHALENE	A,B	1O7G	0.78
I4B	ISOBUTYLBENZENE	A	184L	0.85
N4B	N-BUTYLBENZENE	A	186L	0.88
PA0	Phenylarsine oxide	A	3E3Z	0.72
ISA	3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID	A	1NX3	0.71
ISA	3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID	A,B	1ALW	0.71
M5P	(S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID	A,B	2YZ3	0.71
TOS	P-SULFINOTOLUENE	H	1ETT	0.74
TOS	P-SULFINOTOLUENE	I	4PAD	0.74
TOS	P-SULFINOTOLUENE	A	1EST	0.74
TOS	P-SULFINOTOLUENE	C,G	2CHA	0.74
TOS	P-SULFINOTOLUENE	E	1PPH	0.74
BPS		A,B	2DE4	0.73
DEN	INDENE	A	183L	0.82
PTF	[(METHYLSULFANYL)METHYL]BENZENE	C,F	1RHQ	0.9
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.71
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.71
TLD	4-methylbenzene-1,2-dithiol	A	2Z94	0.82
IBZ	2-IODOBENZYLTHIO GROUP	A,B	1CEL	0.9
PHG	PHENYLMERCURY	A	1CZS	0.73
BNZ	BENZENE	A	1L83	0.73
BNZ	BENZENE	A	1CP4	0.73
BNZ	BENZENE	A,B,C,D	1XXJ	0.73
BNZ	BENZENE	B	1SWI	0.73
BNZ	BENZENE	A	181L	0.73
BNZ	BENZENE	A	223L	0.73
BNZ	BENZENE	A	3DMX	0.73
BNZ	BENZENE	A	2Z9G	0.73
BNZ	BENZENE	A	220L	0.73
BNZ	BENZENE	A	227L	0.73
BNZ	BENZENE	A,B	1A7Z	0.73
BNZ	BENZENE	A	1L84	0.73
PEY	PHENANTHRENE	A,B	2HML	0.72
PEY	PHENANTHRENE	A,B	2HMK	0.72
PMS	BENZYLSULFINIC ACID	B	1PNM	0.84
PMS	BENZYLSULFINIC ACID	A,B	1SH7	0.84
PMS	BENZYLSULFINIC ACID	B,C	1BB0	0.84
PMS	BENZYLSULFINIC ACID	A,B	1S2N	0.84
PMS	BENZYLSULFINIC ACID	A,B	1WB8	0.84
PMS	BENZYLSULFINIC ACID	A,B,C	3CE4	0.84
PMS	BENZYLSULFINIC ACID	A,B	1Y9Z	0.84
PMS	BENZYLSULFINIC ACID	A	3H18	0.84
PMS	BENZYLSULFINIC ACID	A	3H17	0.84
PMS	BENZYLSULFINIC ACID	A	2CBG	0.84
PMS	BENZYLSULFINIC ACID	A	1SUP	0.84
PMS	BENZYLSULFINIC ACID	A,B	1V6C	0.84
PMS	BENZYLSULFINIC ACID	A,B	1WPR	0.84
PMS	BENZYLSULFINIC ACID	A,B	1EQ9	0.84
PMS	BENZYLSULFINIC ACID	A,B	1AUR	0.84
PMS	BENZYLSULFINIC ACID	A	1KLT	0.84
PMS	BENZYLSULFINIC ACID	B,C	1CA8	0.84
PMS	BENZYLSULFINIC ACID	A	2GKO	0.84
PMS	BENZYLSULFINIC ACID	B,C,D	1BA8	0.84
FPR	PROPYLBENZENE	C	1RHK	0.88
PEL	2-PHENYL-ETHANOL	A,B	1I0D	0.72
PEL	2-PHENYL-ETHANOL	D,H	2I0T	0.72
PEL	2-PHENYL-ETHANOL	A,B	1HZY	0.72
PEL	2-PHENYL-ETHANOL	A,B	1I0B	0.72
PEL	2-PHENYL-ETHANOL	A	1EYW	0.72
PEL	2-PHENYL-ETHANOL	A,B	1JGM	0.72
260	2-(bromomethyl)-1,3-difluorobenzene	X	2RB0	0.72
2IB	2-IODOBENZYL GROUP	I,J,K,L,M,N,O,P	1GUL	0.79
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.85
3PL	3-PHENYLPROPANAL	E	1Y3G	0.74
B70	tripotassium (1R)-4-biphenyl-4-yl-1-phosphonatobutane-1-sulfonate	A	2ZCS	0.71
4BT	2-{2-[4-(2-CARBAMIMIDOYLSULFANYL-ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA	A,B	1D1X	0.74
AN3	ANTHRACENE	A,B	2HMN	0.72
AN3	ANTHRACENE	A,B	2HMM	0.72
TSU	PARA-TOLUENE SULFONATE	A,B	1WUW	0.73
TSU	PARA-TOLUENE SULFONATE	A	1B0D	0.73
3BT	2-{2-[3-(2-CARBAMIMIDOYLSULFANYL-ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA	A,B	1D1Y	0.74
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.72
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.72