Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00644044

Ligand	Ligand name	Chain	PDB	Tanimoto
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.73
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.71
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
271	N-methyl-1-phenylmethanamine	X	2RBT	0.82
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.75
53U	D-phenylalanyl-N-benzyl-L-prolinamide	H,I	2ZFF	0.72
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.74
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.74
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.74
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.74
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.74
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.74
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.74
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.74
U1N	4-[(3R)-3-{[2-(4-FLUOROPHENYL)-2-OXOETHYL]AMINO}BUTYL]BENZAMIDE	A,B	2OGZ	0.73
KR2	(2R)-4-(2-BENZOYL-1,2-DIAZEPAN-1-YL)-4-OXO-1-(2,4,5-TRIFLUOROPHENYL)BUTAN-2-AMINE	A,B	2OLE	0.7
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
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine	A	2JJG	0.8
998	N-METHYLALANYL-3-METHYLVALYL-N-(1,2,3,4-TETRAHYDRONAPHTHALEN-1-YL)PROLINAMIDE	A	1TFQ	0.7
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.74
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.77
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.77
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N-DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.78
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.7
A8B		A	1ODC	0.72
DPK	DEPRENYL	A,B	2BYB	0.81
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.71
FPB	N-({(2S)-1-[(3R)-3-AMINO-4-(2-FLUOROPHENYL)BUTANOYL]PYRROLIDIN-2-YL}METHYL)BENZAMIDE	A,B	2BUB	0.73
SP8	N-{(1S)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNS	0.74
N2T	(2S)-4-(2,5-DIFLUOROPHENYL)-N-METHYL-2-PHENYL-N-PIPERIDIN-4-YL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FKY	0.85
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.76
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.76
F1H	N-(1-benzylpiperidin-4-yl)-4-sulfanylbutanamide	A	2ZJH	0.8
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.75
SKF	1,2,3,4-TETRAHYDRO-ISOQUINOLINE-7-SULFONIC ACID AMIDE	A,B	1HNN	0.72
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.74
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.74
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.73
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.81
N4T	(1S)-1-CYCLOPROPYL-2-[(2S)-4-(2,5-DIFLUOROPHENYL)-2-PHENYL-2,5-DIHYDRO-1H-PYRROL-1-YL]-2-OXOETHANAMINE	A,B	2FL2	0.75
FTS	(3R)-3-(FLUOROMETHYL)-N-(3,3,3-TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-7-SULFONAMIDE	A,B	2G71	0.74
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.71
LPF	1,1,1-TRIFLUORO-3-((N-ACETYL)-L-LEUCYLAMIDO)-4-PHENYL-BUTAN-2-ONE(N-ACETYL-L-LEUCYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	G	7GCH	0.7
SP9	N-{(1R)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNT	0.74
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.73
PSS	ETHYLAMINOBENZYLMETHYLCARBONYL GROUP	A	1EAG	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
37U	D-phenylalanyl-N-(3-fluorobenzyl)-L-prolinamide	H,I	2ZDV	0.75
MBH	1-BENZYL-1-METHYL-1-(2-ACETYL)HYDRAZINIUM ION	A	1BMA	0.71
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.81
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.82
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.76
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.76
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.8
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.8
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.8
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.8
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
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.76
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.76
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.76
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.72
CPU		A,B	1CR6	0.76
IDM	INDOLINE	A,B	3CEP	0.7
IDM	INDOLINE	A	1AEK	0.7
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.84
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.71
F1J	(2S)-4-(4-fluorobenzyl)-N-(2-sulfanylethyl)piperazine-2-carboxamide	A	2ZJJ	0.79
SKA	7,8-DICHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE	A,B	1YZ3	0.71
F21	(3R)-3-(FLUOROMETHYL)-7-(THIOMORPHOLIN-4-YLSULFONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE	A,B	2G72	0.7
F21	(3R)-3-(FLUOROMETHYL)-7-(THIOMORPHOLIN-4-YLSULFONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE	A,B	2OPB	0.7
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.73
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.73
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.73
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.73
008	(S)-2-[(R)-3-AMINO-4-(2-FLUORO-PHENYL)-BUTYRYL]-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID AMIDE	A,B,C,D	2BUC	0.75
51U	D-phenylalanyl-N-(3-methylbenzyl)-L-prolinamide	H,I	2ZF0	0.72
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.78
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.78
565	(3R)-4-[(3R)-3-AMINO-4-(2,4,5-TRIFLUOROPHENYL)BUTANOYL]-3-METHYL-1,4-DIAZEPAN-2-ONE	A,B	2IIV	0.72
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.76
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.76
MN2	1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE	N	1NLO	0.72
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.72
F1K	(2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide	A,B,C	2ZJK	0.79
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.76
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.72
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.77
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.77