Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02839310

Ligand	Ligand name	Chain	PDB	Tanimoto
DPK	DEPRENYL	A,B	2BYB	0.96
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine	A	2JJG	0.89
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.88
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.88
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.88
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.86
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.86
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.86
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.86
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.86
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.86
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.84
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.84
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.83
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.83
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.83
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.83
271	N-methyl-1-phenylmethanamine	X	2RBT	0.82
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.82
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.82
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.82
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.82
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.82
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.82
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.82
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.82
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A	2AI7	0.81
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A,B,C	2AI8	0.81
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.81
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.8
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.79
N4B	N-BUTYLBENZENE	A	186L	0.79
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.79
PYL	PHENYLETHANE	C	1B07	0.79
PYL	PHENYLETHANE	A,B	2VRM	0.79
PYL	PHENYLETHANE	A	1NHB	0.79
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.79
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.79
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.79
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.79
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.79
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.79
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.79
FPR	PROPYLBENZENE	C	1RHK	0.79
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.78
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.78
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.78
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.78
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.78
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE-1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2P1C	0.78
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE-1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2Z7H	0.78
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.78
I4B	ISOBUTYLBENZENE	A	184L	0.77
PXY	PARA-XYLENE	A	187L	0.77
PXY	PARA-XYLENE	A	225L	0.77
OXE	ORTHO-XYLENE	A,B	3E0X	0.77
OXE	ORTHO-XYLENE	A	188L	0.77
CPU		A,B	1CR6	0.77
ABN	BENZYLAMINE	D,H	2HXC	0.77
ABN	BENZYLAMINE	A,I	1A86	0.77
ABN	BENZYLAMINE	A	1UTN	0.77
ABN	BENZYLAMINE	A	1N6X	0.77
ABN	BENZYLAMINE	A	2BZA	0.77
ABN	BENZYLAMINE	A	2EUS	0.77
ABN	BENZYLAMINE	A	1N6Y	0.77
ABN	BENZYLAMINE	A	1UTJ	0.77
DP4	TRANS-2-(DIMETHYLPHENYLSILYL)-PIPERIDINE-N-OXIDE	A,B,C,D,E,F,G,H	1ND0	0.76
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.76
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.76
MBN	TOLUENE	A,B	3D7O	0.76
MBN	TOLUENE	A,B	1R1X	0.76
MBN	TOLUENE	A,B	1JLX	0.76
MBN	TOLUENE	A,B,C,D	3D17	0.76
MBN	TOLUENE	A,B	2VRL	0.76
MBN	TOLUENE	A,I	2Z3E	0.76
MBN	TOLUENE	A,B	1YZI	0.76
MBN	TOLUENE	A,B	2DN1	0.76
MBN	TOLUENE	A,B	3EN1	0.76
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.76
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.75
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.75
HPQ	HOMOPHENYLALANINYLMETHANE	B	1EWP	0.74
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.74
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.74
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.74
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.74
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.74
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.74
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.74
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.74
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.74
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.74
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.74
PHM	PHENYLALANYLMETHANE	A,I	1PJP	0.74
PHM	PHENYLALANYLMETHANE	A,B,C	2J9J	0.74
PHM	PHENYLALANYLMETHANE	A,B,C	2JE4	0.74
PSS	ETHYLAMINOBENZYLMETHYLCARBONYL GROUP	A	1EAG	0.73
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.72
2IB	2-IODOBENZYL GROUP	I,J,K,L,M,N,O,P	1GUL	0.72
2HT	3-methylbenzonitrile	A,B	3F88	0.72
MFG	(1Z)-4-(4-FLUOROPHENYL)-2-METHYLIDENEBUTAN-1-IMINE	A,B	2VZ2	0.72
DEN	INDENE	A	183L	0.72
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N-DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.72
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.72
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.72
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.72
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.72
PHL	L-PHENYLALANINOL	A,B	1JOH	0.71
PHL	L-PHENYLALANINOL	I	3APR	0.71
PHL	L-PHENYLALANINOL	A	1DLZ	0.71
PHL	L-PHENYLALANINOL	A	1IH9	0.71
PHL	L-PHENYLALANINOL	A	1OB4	0.71
PHL	L-PHENYLALANINOL	I	2ER6	0.71
PHL	L-PHENYLALANINOL	A	1R9U	0.71
PHL	L-PHENYLALANINOL	A	1OB7	0.71
PHL	L-PHENYLALANINOL	A,B	1OB6	0.71
PHL	L-PHENYLALANINOL	A,B,C	1AMT	0.71
PDH	(2S)-2-AMINO-3-PHENYL-1-PROPANOL	A	1GQ0	0.71
NFA	PHENYLALANINE AMIDE	A,B,C,D	2BTJ	0.71
NFA	PHENYLALANINE AMIDE	A,B,C,D,E,F	2EFX	0.71
NFA	PHENYLALANINE AMIDE	A,B,C,D	2VVJ	0.71
NFA	PHENYLALANINE AMIDE	A	2A4O	0.71
NFA	PHENYLALANINE AMIDE	A,B	1XAE	0.71
NFA	PHENYLALANINE AMIDE	A,B,C,D	2OGR	0.71
NFA	PHENYLALANINE AMIDE	A,B,C,D	1QA7	0.71
NFA	PHENYLALANINE AMIDE	A,B,C,D	2GW4	0.71
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.71
PHA	PHENYLALANINAL	A,B	1OB2	0.71
PHA	PHENYLALANINAL	V,Y,Z	2WDG	0.71
PHA	PHENYLALANINAL	V,Y,Z	2WDK	0.71
PHA	PHENYLALANINAL	1,2,4,5,A,B,C,D,E,J,K,L,M,N,O,P,R,S,T,U,V,Z	1M90	0.71
PHA	PHENYLALANINAL	P	3SGA	0.71
PHA	PHENYLALANINAL	A,B,C,D,E,F	1OB5	0.71
PHA	PHENYLALANINAL	V,Y,Z	2WDM	0.71
PHA	PHENYLALANINAL	0,2,4,9,A,B,C,H,I,J,K,L,M,N,P,Q,R,S,T,X,Y,Z	1KQS	0.71
PHA	PHENYLALANINAL	A,B	1KDV	0.71
PHA	PHENYLALANINAL	1,2,4,5,6,A,B,C,D,E,J,K,L,M,N,O,P,R,S,T,U,V,Z	1Q86	0.71
PHA	PHENYLALANINAL	A,B	1KDY	0.71
PHA	PHENYLALANINAL	V,Y,Z	3FIC	0.71
PHA	PHENYLALANINAL	V,Y,Z	2WDH	0.71
PHA	PHENYLALANINAL	A,B	1KE2	0.71
PRY	2-PROPYL-ANILINE	A	1OWY	0.71
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	A,B,I	1ZSR	0.71
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1ZJ7	0.71
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1ZLF	0.71
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1HEG	0.71
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1FQX	0.71
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	A,B,I	1IIQ	0.71
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1HEF	0.71
MBH	1-BENZYL-1-METHYL-1-(2-ACETYL)HYDRAZINIUM ION	A	1BMA	0.71
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B,I	1ZSF	0.71
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A	1JLD	0.71
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B	1IDA	0.71
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B	1IDB	0.71
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B,I	1Z8C	0.71
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B,I	1ZBG	0.71
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B,I	1ZPK	0.71
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.71
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.7
APE	(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACID	E,I	1SCN	0.7