Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00010263

Ligand	Ligand name	Chain	PDB	Tanimoto
FBS	4-FLOUROBENZENESULFONAMIDE	A	1IF4	0.76
B70	tripotassium (1R)-4-biphenyl-4-yl-1-phosphonatobutane-1-sulfonate	A	2ZCS	0.74
FPR	PROPYLBENZENE	C	1RHK	0.75
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOJ	0.75
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOL	0.75
TLD	4-methylbenzene-1,2-dithiol	A	2Z94	0.73
OXE	ORTHO-XYLENE	A,B	3E0X	0.73
OXE	ORTHO-XYLENE	A	188L	0.73
PVS	(ethenylsulfonyl)benzene	A	3BLU	0.75
HZH	1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan-2-one	A,B	3DEA	0.71
BNS	HYDROSULFONYLBENZENE	1	1YYY	0.76
BNS	HYDROSULFONYLBENZENE	A	1MEM	0.76
BNS	HYDROSULFONYLBENZENE	A,D,E	1FH0	0.76
BNS	HYDROSULFONYLBENZENE	A,B,C,D	1PQ9	0.76
MBN	TOLUENE	A,B	3D7O	0.77
MBN	TOLUENE	A,B	1R1X	0.77
MBN	TOLUENE	A,B	1JLX	0.77
MBN	TOLUENE	A,B,C,D	3D17	0.77
MBN	TOLUENE	A,B	2VRL	0.77
MBN	TOLUENE	A,I	2Z3E	0.77
MBN	TOLUENE	A,B	1YZI	0.77
MBN	TOLUENE	A,B	2DN1	0.77
MBN	TOLUENE	A,B	3EN1	0.77
TOS	P-SULFINOTOLUENE	H	1ETT	0.8
TOS	P-SULFINOTOLUENE	I	4PAD	0.8
TOS	P-SULFINOTOLUENE	A	1EST	0.8
TOS	P-SULFINOTOLUENE	C,G	2CHA	0.8
TOS	P-SULFINOTOLUENE	E	1PPH	0.8
TSU	PARA-TOLUENE SULFONATE	A,B	1WUW	0.81
TSU	PARA-TOLUENE SULFONATE	A	1B0D	0.81
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.76
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.76
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.76
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.76
PXY	PARA-XYLENE	A	187L	0.75
PXY	PARA-XYLENE	A	225L	0.75
2IB	2-IODOBENZYL GROUP	I,J,K,L,M,N,O,P	1GUL	0.72
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.71
BDB		A,B	1KE3	0.72
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.74
FBU	3,5-DIFLUOROBENZENESULFONAMIDE	A	1IF6	0.74
PMS	BENZYLSULFINIC ACID	B	1PNM	0.9
PMS	BENZYLSULFINIC ACID	A,B	1SH7	0.9
PMS	BENZYLSULFINIC ACID	B,C	1BB0	0.9
PMS	BENZYLSULFINIC ACID	A,B	1S2N	0.9
PMS	BENZYLSULFINIC ACID	A,B	1WB8	0.9
PMS	BENZYLSULFINIC ACID	A,B,C	3CE4	0.9
PMS	BENZYLSULFINIC ACID	A,B	1Y9Z	0.9
PMS	BENZYLSULFINIC ACID	A	3H18	0.9
PMS	BENZYLSULFINIC ACID	A	3H17	0.9
PMS	BENZYLSULFINIC ACID	A	2CBG	0.9
PMS	BENZYLSULFINIC ACID	A	1SUP	0.9
PMS	BENZYLSULFINIC ACID	A,B	1V6C	0.9
PMS	BENZYLSULFINIC ACID	A,B	1WPR	0.9
PMS	BENZYLSULFINIC ACID	A,B	1EQ9	0.9
PMS	BENZYLSULFINIC ACID	A,B	1AUR	0.9
PMS	BENZYLSULFINIC ACID	A	1KLT	0.9
PMS	BENZYLSULFINIC ACID	B,C	1CA8	0.9
PMS	BENZYLSULFINIC ACID	A	2GKO	0.9
PMS	BENZYLSULFINIC ACID	B,C,D	1BA8	0.9
SML	PHENYL METHYL SULFONE	A,I	1D6W	0.74
SML	PHENYL METHYL SULFONE	A,I	1D9I	0.74
I4B	ISOBUTYLBENZENE	A	184L	0.73
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D73	0.71
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D77	0.71
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D78	0.71
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3CZ1	0.71
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D75	0.71
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D76	0.71
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3BJH	0.71
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D74	0.71
NAS	2-NAPHTHALENESULFONIC ACID	I	1QUR	0.71
NAS	2-NAPHTHALENESULFONIC ACID	E,I	1PPC	0.71
NAS	2-NAPHTHALENESULFONIC ACID	H	1ETS	0.71
BPS		A,B	2DE4	0.74
PYL	PHENYLETHANE	C	1B07	0.75
PYL	PHENYLETHANE	A,B	2VRM	0.75
PYL	PHENYLETHANE	A	1NHB	0.75
B69		A	2ZCR	0.73
MAJ	indane-5-sulfonamide	A	2QOA	0.8
FBT	2,6-DIFLUOROBENZENESULFONAMIDE	A	1IF5	0.76
787	(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACID	A	1O4R	0.71
PTF	[(METHYLSULFANYL)METHYL]BENZENE	C,F	1RHQ	0.8
PMB	PARA-MERCURY-BENZENESULFONIC ACID	B	1BH9	0.72
PMB	PARA-MERCURY-BENZENESULFONIC ACID	H	1HDK	0.72
PMB	PARA-MERCURY-BENZENESULFONIC ACID	A	1HJ1	0.72
PMB	PARA-MERCURY-BENZENESULFONIC ACID	A,B,C,D	1YP2	0.72
PMB	PARA-MERCURY-BENZENESULFONIC ACID	A	1XZC	0.72
N4B	N-BUTYLBENZENE	A	186L	0.75
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.71
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.71
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.71
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.71
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.71
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2OUA	0.72
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B,C,D	2AJC	0.72
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	3PRO	0.72
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2PFE	0.72
IBZ	2-IODOBENZYLTHIO GROUP	A,B	1CEL	0.8
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.78
SEH	S-BENZYL PHENYLACETOTHIOHYDROXIMATE-O-SULFATE	M	1W9D	0.71
ZYX	4-(2-AMINOETHYL)BENZENESULFONAMIDE	A	2NNG	0.76