Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03275015

Ligand	Ligand name	Chain	PDB	Tanimoto
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D73	0.82
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D77	0.82
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D78	0.82
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3CZ1	0.82
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D75	0.82
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3D76	0.82
NBB	N-BUTYL-BENZENESULFONAMIDE	A	3BJH	0.82
NBB	N-BUTYL-BENZENESULFONAMIDE	A,B	3D74	0.82
MBN	TOLUENE	A,B	3D7O	0.7
MBN	TOLUENE	A,B	1R1X	0.7
MBN	TOLUENE	A,B	1JLX	0.7
MBN	TOLUENE	A,B,C,D	3D17	0.7
MBN	TOLUENE	A,B	2VRL	0.7
MBN	TOLUENE	A,I	2Z3E	0.7
MBN	TOLUENE	A,B	1YZI	0.7
MBN	TOLUENE	A,B	2DN1	0.7
MBN	TOLUENE	A,B	3EN1	0.7
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.78
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.77
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.77
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.71
PMS	BENZYLSULFINIC ACID	B	1PNM	0.79
PMS	BENZYLSULFINIC ACID	A,B	1SH7	0.79
PMS	BENZYLSULFINIC ACID	B,C	1BB0	0.79
PMS	BENZYLSULFINIC ACID	A,B	1S2N	0.79
PMS	BENZYLSULFINIC ACID	A,B	1WB8	0.79
PMS	BENZYLSULFINIC ACID	A,B,C	3CE4	0.79
PMS	BENZYLSULFINIC ACID	A,B	1Y9Z	0.79
PMS	BENZYLSULFINIC ACID	A	3H18	0.79
PMS	BENZYLSULFINIC ACID	A	3H17	0.79
PMS	BENZYLSULFINIC ACID	A	2CBG	0.79
PMS	BENZYLSULFINIC ACID	A	1SUP	0.79
PMS	BENZYLSULFINIC ACID	A,B	1V6C	0.79
PMS	BENZYLSULFINIC ACID	A,B	1WPR	0.79
PMS	BENZYLSULFINIC ACID	A,B	1EQ9	0.79
PMS	BENZYLSULFINIC ACID	A,B	1AUR	0.79
PMS	BENZYLSULFINIC ACID	A	1KLT	0.79
PMS	BENZYLSULFINIC ACID	B,C	1CA8	0.79
PMS	BENZYLSULFINIC ACID	A	2GKO	0.79
PMS	BENZYLSULFINIC ACID	B,C,D	1BA8	0.79
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.7
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.79
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.79
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.79
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.79
MAJ	indane-5-sulfonamide	A	2QOA	0.74
ZYX	4-(2-AMINOETHYL)BENZENESULFONAMIDE	A	2NNG	0.85
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.78
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.78
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.78
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.78
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.72
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.72
PTF	[(METHYLSULFANYL)METHYL]BENZENE	C,F	1RHQ	0.75
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.71
BHY	N,N'-[biphenyl-4,4'-diyldi(2R)propane-2,1-diyl]dimethanesulfonamide	A,B	3BBR	0.79
HS7	N-oxo-2-(phenylsulfonylamino)ethanamide	A	3F1A	0.7
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2OUA	0.8
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B,C,D	2AJC	0.8
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	3PRO	0.8
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2PFE	0.8
PYL	PHENYLETHANE	C	1B07	0.71
PYL	PHENYLETHANE	A,B	2VRM	0.71
PYL	PHENYLETHANE	A	1NHB	0.71
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.78
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.78
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.78
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.78
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.78
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.78
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.78
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.78
SEH	S-BENZYL PHENYLACETOTHIOHYDROXIMATE-O-SULFATE	M	1W9D	0.7
N4B	N-BUTYLBENZENE	A	186L	0.71
SEB	O-BENZYLSULFONYL-SERINE	A,B,C,D	2APJ	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1IAV	0.75
SEB	O-BENZYLSULFONYL-SERINE	A,B	1IEC	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1ZIY	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1C9N	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1ZJ4	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1GGV	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1Q5P	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1PQA	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1ZJ5	0.75
SEB	O-BENZYLSULFONYL-SERINE	A	1C9M	0.75
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.71
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.71
BCS	BENZYLCYSTEINE	A,B,G,H	10GS	0.73
BCS	BENZYLCYSTEINE	A	1EH8	0.73
PXY	PARA-XYLENE	A	187L	0.71
PXY	PARA-XYLENE	A	225L	0.71
ABN	BENZYLAMINE	D,H	2HXC	0.74
ABN	BENZYLAMINE	A,I	1A86	0.74
ABN	BENZYLAMINE	A	1UTN	0.74
ABN	BENZYLAMINE	A	1N6X	0.74
ABN	BENZYLAMINE	A	2BZA	0.74
ABN	BENZYLAMINE	A	2EUS	0.74
ABN	BENZYLAMINE	A	1N6Y	0.74
ABN	BENZYLAMINE	A	1UTJ	0.74
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.73
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.73
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.73
TOS	P-SULFINOTOLUENE	H	1ETT	0.73
TOS	P-SULFINOTOLUENE	I	4PAD	0.73
TOS	P-SULFINOTOLUENE	A	1EST	0.73
TOS	P-SULFINOTOLUENE	C,G	2CHA	0.73
TOS	P-SULFINOTOLUENE	E	1PPH	0.73
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.78
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.78
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.72
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.84
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.84
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.84
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.84
271	N-methyl-1-phenylmethanamine	X	2RBT	0.72
TSU	PARA-TOLUENE SULFONATE	A,B	1WUW	0.74
TSU	PARA-TOLUENE SULFONATE	A	1B0D	0.74
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOJ	0.71
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOL	0.71
FPR	PROPYLBENZENE	C	1RHK	0.71
IBZ	2-IODOBENZYLTHIO GROUP	A,B	1CEL	0.71
M25	N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE	A,B	2NMX	0.75
M25	N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE	A	2NNS	0.75
HS4	N-oxo-2-[(4-phenylphenyl)sulfonylamino]ethanamide	A	3F17	0.72
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.8
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.8
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.8
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.8
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.8