Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02543842

Ligand	Ligand name	Chain	PDB	Tanimoto
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.72
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.72
PXY	PARA-XYLENE	A	187L	0.78
PXY	PARA-XYLENE	A	225L	0.78
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.84
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.84
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.84
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.84
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.84
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.84
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.84
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.84
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.83
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.83
DPK	DEPRENYL	A,B	2BYB	0.82
MFG	(1Z)-4-(4-FLUOROPHENYL)-2-METHYLIDENEBUTAN-1-IMINE	A,B	2VZ2	0.73
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.79
2HT	3-methylbenzonitrile	A,B	3F88	0.73
MBN	TOLUENE	A,B	3D7O	0.75
MBN	TOLUENE	A,B	1R1X	0.75
MBN	TOLUENE	A,B	1JLX	0.75
MBN	TOLUENE	A,B,C,D	3D17	0.75
MBN	TOLUENE	A,B	2VRL	0.75
MBN	TOLUENE	A,I	2Z3E	0.75
MBN	TOLUENE	A,B	1YZI	0.75
MBN	TOLUENE	A,B	2DN1	0.75
MBN	TOLUENE	A,B	3EN1	0.75
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.7
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.7
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.7
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A	2AI7	0.75
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A,B,C	2AI8	0.75
PHM	PHENYLALANYLMETHANE	A,I	1PJP	0.71
PHM	PHENYLALANYLMETHANE	A,B,C	2J9J	0.71
PHM	PHENYLALANYLMETHANE	A,B,C	2JE4	0.71
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.78
FPR	PROPYLBENZENE	C	1RHK	0.78
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.83
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.75
BDB		A,B	1KE3	0.7
BHY	N,N'-[biphenyl-4,4'-diyldi(2R)propane-2,1-diyl]dimethanesulfonamide	A,B	3BBR	0.71
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.72
ZYX	4-(2-AMINOETHYL)BENZENESULFONAMIDE	A	2NNG	0.7
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.82
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.82
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.82
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.82
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.72
GVQ	(2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE	A	2UW8	0.7
ABN	BENZYLAMINE	D,H	2HXC	0.79
ABN	BENZYLAMINE	A,I	1A86	0.79
ABN	BENZYLAMINE	A	1UTN	0.79
ABN	BENZYLAMINE	A	1N6X	0.79
ABN	BENZYLAMINE	A	2BZA	0.79
ABN	BENZYLAMINE	A	2EUS	0.79
ABN	BENZYLAMINE	A	1N6Y	0.79
ABN	BENZYLAMINE	A	1UTJ	0.79
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.76
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.76
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.72
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.72
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.72
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.72
I4B	ISOBUTYLBENZENE	A	184L	0.79
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2OUA	0.7
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B,C,D	2AJC	0.7
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	3PRO	0.7
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2PFE	0.7
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.71
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.74
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.74
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.79
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.79
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
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.83
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.79
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.74
OXE	ORTHO-XYLENE	A,B	3E0X	0.76
OXE	ORTHO-XYLENE	A	188L	0.76
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.83
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.83
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.83
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.83
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.82
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.82
HPQ	HOMOPHENYLALANINYLMETHANE	B	1EWP	0.71
PYL	PHENYLETHANE	C	1B07	0.78
PYL	PHENYLETHANE	A,B	2VRM	0.78
PYL	PHENYLETHANE	A	1NHB	0.78
DEN	INDENE	A	183L	0.71
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine	A	2JJG	0.77
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.71
271	N-methyl-1-phenylmethanamine	X	2RBT	0.78
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.73
N4B	N-BUTYLBENZENE	A	186L	0.78
PTF	[(METHYLSULFANYL)METHYL]BENZENE	C,F	1RHQ	0.71
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.72
2IB	2-IODOBENZYL GROUP	I,J,K,L,M,N,O,P	1GUL	0.71
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.78
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
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.71
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.71
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.71