Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00546710

Ligand	Ligand name	Chain	PDB	Tanimoto
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.84
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.74
SKF	1,2,3,4-TETRAHYDRO-ISOQUINOLINE-7-SULFONIC ACID AMIDE	A,B	1HNN	0.75
KHA	1-(4-{[(2-HYDROXYETHYL)AMINO]CARBONYL}BENZYL)-1-METHYLPIPERIDINIUM	H,L,X,Y	1UWG	0.7
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.77
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.77
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.77
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.77
CPU		A,B	1CR6	0.73
F1J	(2S)-4-(4-fluorobenzyl)-N-(2-sulfanylethyl)piperazine-2-carboxamide	A	2ZJJ	0.74
APE	(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACID	E,I	1SCN	0.71
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.77
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.77
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.77
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.77
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.77
SP8	N-{(1S)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNS	0.72
53U	D-phenylalanyl-N-benzyl-L-prolinamide	H,I	2ZFF	0.7
ABN	BENZYLAMINE	D,H	2HXC	0.82
ABN	BENZYLAMINE	A,I	1A86	0.82
ABN	BENZYLAMINE	A	1UTN	0.82
ABN	BENZYLAMINE	A	1N6X	0.82
ABN	BENZYLAMINE	A	2BZA	0.82
ABN	BENZYLAMINE	A	2EUS	0.82
ABN	BENZYLAMINE	A	1N6Y	0.82
ABN	BENZYLAMINE	A	1UTJ	0.82
F1K	(2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide	A,B,C	2ZJK	0.74
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.78
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.78
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.78
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.78
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.78
SKA	7,8-DICHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE	A,B	1YZ3	0.74
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.79
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.79
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.84
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.79
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.79
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine	A	2JJG	0.8
BEN	BENZAMIDINE	A	2TIO	0.72
BEN	BENZAMIDINE	A	1J15	0.72
BEN	BENZAMIDINE	A,B	3BEU	0.72
BEN	BENZAMIDINE	T	1V2U	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF8	0.72
BEN	BENZAMIDINE	A	1S0R	0.72
BEN	BENZAMIDINE	A,B	1V16	0.72
BEN	BENZAMIDINE	A	1CC7	0.72
BEN	BENZAMIDINE	A	3BG8	0.72
BEN	BENZAMIDINE	A	1CC8	0.72
BEN	BENZAMIDINE	A	3PTB	0.72
BEN	BENZAMIDINE	A,B	1TRM	0.72
BEN	BENZAMIDINE	A	1ZHR	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	1NKZ	0.72
BEN	BENZAMIDINE	A	2BLV	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLP	0.72
BEN	BENZAMIDINE	H,I	3D49	0.72
BEN	BENZAMIDINE	H,L,T	2AER	0.72
BEN	BENZAMIDINE	A	1J14	0.72
BEN	BENZAMIDINE	A	1NSA	0.72
BEN	BENZAMIDINE	A	2AYW	0.72
BEN	BENZAMIDINE	A	1BRA	0.72
BEN	BENZAMIDINE	A,B,C,D	1A0J	0.72
BEN	BENZAMIDINE	B,C,D	2AST	0.72
BEN	BENZAMIDINE	A,B	2CKR	0.72
BEN	BENZAMIDINE	A	1LPU	0.72
BEN	BENZAMIDINE	A	1ZHM	0.72
BEN	BENZAMIDINE	A	1J8A	0.72
BEN	BENZAMIDINE	A,B	3BCX	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF9	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3D04	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLL	0.72
BEN	BENZAMIDINE	A	1AND	0.72
BEN	BENZAMIDINE	A	2TBS	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP2	0.72
BEN	BENZAMIDINE	T	1V2M	0.72
BEN	BENZAMIDINE	A	2EEK	0.72
BEN	BENZAMIDINE	H,I	2ZI2	0.72
BEN	BENZAMIDINE	T	1V2J	0.72
BEN	BENZAMIDINE	H	1KLI	0.72
BEN	BENZAMIDINE	A	1CE5	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3B7J	0.72
BEN	BENZAMIDINE	B,Y	2PKA	0.72
BEN	BENZAMIDINE	A	2VJ0	0.72
BEN	BENZAMIDINE	A	3B3J	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOY	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP3	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLM	0.72
BEN	BENZAMIDINE	A	1ANB	0.72
BEN	BENZAMIDINE	A	1LO6	0.72
BEN	BENZAMIDINE	A	1LR4	0.72
BEN	BENZAMIDINE	A,B	1V1M	0.72
BEN	BENZAMIDINE	A	1ZHP	0.72
BEN	BENZAMIDINE	A	2J9N	0.72
BEN	BENZAMIDINE	A	2BMV	0.72
BEN	BENZAMIDINE	A,B	2CKS	0.72
BEN	BENZAMIDINE	A	2BLW	0.72
BEN	BENZAMIDINE	A	1J16	0.72
BEN	BENZAMIDINE	A,B	1V11	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP0	0.72
BEN	BENZAMIDINE	B	1RTF	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP1	0.72
BEN	BENZAMIDINE	A,B,C,D	2E58	0.72
BEN	BENZAMIDINE	A	2TRM	0.72
BEN	BENZAMIDINE	T	1V2V	0.72
BEN	BENZAMIDINE	A	1MBQ	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOZ	0.72
BEN	BENZAMIDINE	A	2O8U	0.72
BEN	BENZAMIDINE	H	1DWB	0.72
BEN	BENZAMIDINE	B,C	2ASS	0.72
BEN	BENZAMIDINE	A	1ANE	0.72
BEN	BENZAMIDINE	H,I	2ZIQ	0.72
BEN	BENZAMIDINE	A	1BIT	0.72
BEN	BENZAMIDINE	A	2AIQ	0.72
BEN	BENZAMIDINE	A	2OQ5	0.72
BEN	BENZAMIDINE	A	1ANC	0.72
BEN	BENZAMIDINE	H	1JBU	0.72
BEN	BENZAMIDINE	A,B	2BPQ	0.72
BEN	BENZAMIDINE	A,B,C,D	2GNN	0.72
BEN	BENZAMIDINE	T	1V2S	0.72
BEN	BENZAMIDINE	A	1H4W	0.72
BEN	BENZAMIDINE	A	1OSS	0.72
BEN	BENZAMIDINE	A	1W80	0.72
BEN	BENZAMIDINE	A	1BTY	0.72
BEN	BENZAMIDINE	H,I	2ZFQ	0.72
BEN	BENZAMIDINE	A	1EAX	0.72
BEN	BENZAMIDINE	A	1L2E	0.72
BEN	BENZAMIDINE	A	1WRI	0.72
BEN	BENZAMIDINE	A,B	3BB8	0.72
BEN	BENZAMIDINE	A	2OXS	0.72
BEN	BENZAMIDINE	A	1DPO	0.72
BEN	BENZAMIDINE	T	1V2L	0.72
LY1	8,9-DICHLORO-2,3,4,5-TETRAHYDRO-1H-BENZO[C]AZEPINE	A,B	1N7I	0.71
N4T	(1S)-1-CYCLOPROPYL-2-[(2S)-4-(2,5-DIFLUOROPHENYL)-2-PHENYL-2,5-DIHYDRO-1H-PYRROL-1-YL]-2-OXOETHANAMINE	A,B	2FL2	0.71
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.78
IDM	INDOLINE	A,B	3CEP	0.71
IDM	INDOLINE	A	1AEK	0.71
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.74
DPK	DEPRENYL	A,B	2BYB	0.81
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.72
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.72
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.76
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.76
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.75
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.77
FTS	(3R)-3-(FLUOROMETHYL)-N-(3,3,3-TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-7-SULFONAMIDE	A,B	2G71	0.71
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.76
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.71
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.71
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.71
N2T	(2S)-4-(2,5-DIFLUOROPHENYL)-N-METHYL-2-PHENYL-N-PIPERIDIN-4-YL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FKY	0.74
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
GVQ	(2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE	A	2UW8	0.7
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.75
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.88
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.8
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.76
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.79
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.73
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.79
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.79
BAM	BENZAMIDINE	U	1F5K	0.72
BAM	BENZAMIDINE	X	2BY8	0.72
BAM	BENZAMIDINE	B	2PSM	0.72
BAM	BENZAMIDINE	X	2BY9	0.72
BAM	BENZAMIDINE	A	1C1N	0.72
BAM	BENZAMIDINE	X	2BY6	0.72
BAM	BENZAMIDINE	H,I	1C5O	0.72
BAM	BENZAMIDINE	A	1XX4	0.72
BAM	BENZAMIDINE	A	1HJ8	0.72
BAM	BENZAMIDINE	A	1C5P	0.72
BAM	BENZAMIDINE	B	1C5Z	0.72
BAM	BENZAMIDINE	A,B	1ZVW	0.72
BAM	BENZAMIDINE	A	2ANW	0.72
BAM	BENZAMIDINE	A	2ANY	0.72
BAM	BENZAMIDINE	X	2BYA	0.72
BAM	BENZAMIDINE	A	1TIO	0.72
BAM	BENZAMIDINE	X	2BY5	0.72
BAM	BENZAMIDINE	X	2BY7	0.72
MBH	1-BENZYL-1-METHYL-1-(2-ACETYL)HYDRAZINIUM ION	A	1BMA	0.76
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.76
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.76
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.76
C2B	1-(4-CHLOROPHENYL)METHANAMINE	D,H	2Q7Q	0.73
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.8
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.8
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.8
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.8
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.8
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.8
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.8
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.8
F1H	N-(1-benzylpiperidin-4-yl)-4-sulfanylbutanamide	A	2ZJH	0.78
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.77
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.71
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.78
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N-DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.71
C2A	1-(3-CHLOROPHENYL)METHANAMINE	B,I	2C8Z	0.73
SP9	N-{(1R)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNT	0.72
271	N-methyl-1-phenylmethanamine	X	2RBT	0.86
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.85
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.79
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.79
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.79
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.74
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.78
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.78
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.83
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.83
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.79
DP4	TRANS-2-(DIMETHYLPHENYLSILYL)-PIPERIDINE-N-OXIDE	A,B,C,D,E,F,G,H	1ND0	0.73
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.79
MN2	1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE	N	1NLO	0.77
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.77
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.77