Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00010707

Ligand	Ligand name	Chain	PDB	Tanimoto
N9H	(5S)-5-(3-AMINOPROPYL)-3-(2,5-DIFLUOROPHENYL)-N-ETHYL-5-PHENYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOXAMIDE	A,B	2G1Q	0.72
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.73
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.73
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.73
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.73
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N-DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.73
SRB	L-1-NAPHTHYL-2-ACETAMIDO-ETHANE BORONIC ACID	B,C	3VGC	0.72
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.73
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.73
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.74
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.75
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	0.77
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.77
CPU		A,B	1CR6	0.74
PRY	2-PROPYL-ANILINE	A	1OWY	0.72
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.79
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.79
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.74
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.7
MN2	1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE	N	1NLO	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	0.75
SRD	D-1-NAPHTHYL-2-ACETAMIDO-ETHANE BORONIC ACID	B,C	4VGC	0.72
34A	3,4-DIMETHYLANILINE	A	1L4K	0.72
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.74
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.74
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.74
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.74
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.74
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.83
ABN	BENZYLAMINE	D,H	2HXC	0.76
ABN	BENZYLAMINE	A,I	1A86	0.76
ABN	BENZYLAMINE	A	1UTN	0.76
ABN	BENZYLAMINE	A	1N6X	0.76
ABN	BENZYLAMINE	A	2BZA	0.76
ABN	BENZYLAMINE	A	2EUS	0.76
ABN	BENZYLAMINE	A	1N6Y	0.76
ABN	BENZYLAMINE	A	1UTJ	0.76
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.75
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.77
37U	D-phenylalanyl-N-(3-fluorobenzyl)-L-prolinamide	H,I	2ZDV	0.71
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.76
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.74
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.79
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.79
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.79
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.79
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.79
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.79
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.79
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.74
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.74
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.82
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
SRE	(1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine	A	3GWU	0.73
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine	A	2JJG	0.75
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.73
271	N-methyl-1-phenylmethanamine	X	2RBT	0.85
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.79
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.74
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.75
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.75
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
N4T	(1S)-1-CYCLOPROPYL-2-[(2S)-4-(2,5-DIFLUOROPHENYL)-2-PHENYL-2,5-DIHYDRO-1H-PYRROL-1-YL]-2-OXOETHANAMINE	A,B	2FL2	0.7
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.78
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.78
IDM	INDOLINE	A,B	3CEP	0.7
IDM	INDOLINE	A	1AEK	0.7
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.75
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.75
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.76
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.81
U1N	4-[(3R)-3-{[2-(4-FLUOROPHENYL)-2-OXOETHYL]AMINO}BUTYL]BENZAMIDE	A,B	2OGZ	0.71
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.8
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.8
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.75
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.79
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.83
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.76
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.76
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.76
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.76
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.76
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.76
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.76
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.76
BHY	N,N'-[biphenyl-4,4'-diyldi(2R)propane-2,1-diyl]dimethanesulfonamide	A,B	3BBR	0.7
DPK	DEPRENYL	A,B	2BYB	0.77
GVQ	(2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE	A	2UW8	0.71
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.74