Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00441745

Ligand	Ligand name	Chain	PDB	Tanimoto
PRY	2-PROPYL-ANILINE	A	1OWY	0.7
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.76
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.77
S27	N-[[2-METHYL-4-HYDROXYCARBAMOYL]BUT-4-YL-N]-BENZYL-P-[PHENYL]-P-[METHYL]PHOSPHINAMID	A,B	1B3D	0.7
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.86
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.8
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.8
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N-DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.73
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY5	0.72
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY8	0.72
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY9	0.72
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XXZ	0.72
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY4	0.72
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY6	0.72
53U	D-phenylalanyl-N-benzyl-L-prolinamide	H,I	2ZFF	0.72
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.71
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.75
SP8	N-{(1S)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNS	0.77
SKF	1,2,3,4-TETRAHYDRO-ISOQUINOLINE-7-SULFONIC ACID AMIDE	A,B	1HNN	0.73
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.81
DPK	DEPRENYL	A,B	2BYB	0.83
DP4	TRANS-2-(DIMETHYLPHENYLSILYL)-PIPERIDINE-N-OXIDE	A,B,C,D,E,F,G,H	1ND0	0.71
998	N-METHYLALANYL-3-METHYLVALYL-N-(1,2,3,4-TETRAHYDRONAPHTHALEN-1-YL)PROLINAMIDE	A	1TFQ	0.7
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.74
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.76
F1H	N-(1-benzylpiperidin-4-yl)-4-sulfanylbutanamide	A	2ZJH	0.82
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.78
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.76
MN2	1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE	N	1NLO	0.76
A8B		A	1ODC	0.72
F1J	(2S)-4-(4-fluorobenzyl)-N-(2-sulfanylethyl)piperazine-2-carboxamide	A	2ZJJ	0.77
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.71
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
NYL	N-ALLYL-ANILINE	A	1OVK	0.71
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.75
MBH	1-BENZYL-1-METHYL-1-(2-ACETYL)HYDRAZINIUM ION	A	1BMA	0.74
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.75
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.73
F1K	(2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide	A,B,C	2ZJK	0.77
37U	D-phenylalanyl-N-(3-fluorobenzyl)-L-prolinamide	H,I	2ZDV	0.71
SKA	7,8-DICHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE	A,B	1YZ3	0.72
PSS	ETHYLAMINOBENZYLMETHYLCARBONYL GROUP	A	1EAG	0.73
271	N-methyl-1-phenylmethanamine	X	2RBT	0.87
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.72
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.81
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.81
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine	A	2JJG	0.81
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.76
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.76
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.74
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.82
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.82
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.82
KHA	1-(4-{[(2-HYDROXYETHYL)AMINO]CARBONYL}BENZYL)-1-METHYLPIPERIDINIUM	H,L,X,Y	1UWG	0.71
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.79
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.79
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.8
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.8
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.8
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.83
FTS	(3R)-3-(FLUOROMETHYL)-N-(3,3,3-TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-7-SULFONAMIDE	A,B	2G71	0.73
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.79
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.79
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.82
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	0.7
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.81
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.81
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.81
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.81
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.81
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.75
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.75
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
CPU		A,B	1CR6	0.76
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.75
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.75
264	(phenylamino)acetonitrile	A	2RBN	0.7
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.72
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.76
N2T	(2S)-4-(2,5-DIFLUOROPHENYL)-N-METHYL-2-PHENYL-N-PIPERIDIN-4-YL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FKY	0.8
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.78
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.78
ABN	BENZYLAMINE	D,H	2HXC	0.78
ABN	BENZYLAMINE	A,I	1A86	0.78
ABN	BENZYLAMINE	A	1UTN	0.78
ABN	BENZYLAMINE	A	1N6X	0.78
ABN	BENZYLAMINE	A	2BZA	0.78
ABN	BENZYLAMINE	A	2EUS	0.78
ABN	BENZYLAMINE	A	1N6Y	0.78
ABN	BENZYLAMINE	A	1UTJ	0.78
SP9	N-{(1R)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNT	0.77
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
51U	D-phenylalanyl-N-(3-methylbenzyl)-L-prolinamide	H,I	2ZF0	0.72
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.8
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.8
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.8
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.8
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
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.79
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.76
IDM	INDOLINE	A,B	3CEP	0.72
IDM	INDOLINE	A	1AEK	0.72
SRE	(1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine	A	3GWU	0.7