Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00445879

Ligand	Ligand name	Chain	PDB	Tanimoto
PRY	2-PROPYL-ANILINE	A	1OWY	0.7
CLB	D-PARA-CHLOROPHENYL-1-ACETAMIDOBORONIC ACID ALANINE	A	1VSB	0.71
2CM	2-CHLORO-6-METHYL-ANILINE	A	1OVH	0.77
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B,I	1ZSF	0.72
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A	1JLD	0.72
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B	1IDA	0.72
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B	1IDB	0.72
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B,I	1Z8C	0.72
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B,I	1ZBG	0.72
PR0	3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL	A,B,I	1ZPK	0.72
C2A	1-(3-CHLOROPHENYL)METHANAMINE	B,I	2C8Z	0.87
V36	L-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACID	B,C	1VGC	0.81
HPQ	HOMOPHENYLALANINYLMETHANE	B	1EWP	0.74
GVQ	(2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE	A	2UW8	0.89
PCS	PHENYLALANYLMETHYLCHLORIDE	B,D	1DLK	0.77
PCS	PHENYLALANYLMETHYLCHLORIDE	A	1XQX	0.77
SKA	7,8-DICHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE	A,B	1YZ3	0.74
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.73
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.74
PHK	(2R,3S)-3-AMINO-1-CHLORO-4-PHENYL-BUTAN-2-OL	A	1MU0	0.74
PHK	(2R,3S)-3-AMINO-1-CHLORO-4-PHENYL-BUTAN-2-OL	A	1XRL	0.74
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.71
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.71
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.71
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.71
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	A,B,I	1ZSR	0.72
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1ZJ7	0.72
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1ZLF	0.72
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1HEG	0.72
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1FQX	0.72
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	A,B,I	1IIQ	0.72
PS0	3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL	I	1HEF	0.72
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.74
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.7
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.75
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.75
PHM	PHENYLALANYLMETHANE	A,I	1PJP	0.76
PHM	PHENYLALANYLMETHANE	A,B,C	2J9J	0.76
PHM	PHENYLALANYLMETHANE	A,B,C	2JE4	0.76
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.84
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.84
FCL	3-CHLORO-L-PHENYLALANINE	E,F	1OKW	0.75
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.87
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.87
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.81
CRP	((1RS,3SR)-2,2-DICHLORO-N-[(R)-1-(4-CHLOROPHENYL)ETHYL]-1-ETHYL-3-METHYLCYCLOPROPANECARBOXAMIDE	A	2STD	0.73
CRP	((1RS,3SR)-2,2-DICHLORO-N-[(R)-1-(4-CHLOROPHENYL)ETHYL]-1-ETHYL-3-METHYLCYCLOPROPANECARBOXAMIDE	A,B,C	7STD	0.73
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.82
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.82
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.72
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.82
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.82
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.73
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.74
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.74
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.83
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.83
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.83
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.83
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.83
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.83
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.83
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.83
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.74
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.74
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.74
LY1	8,9-DICHLORO-2,3,4,5-TETRAHYDRO-1H-BENZO[C]AZEPINE	A,B	1N7I	0.77
PHA	PHENYLALANINAL	A,B	1OB2	0.73
PHA	PHENYLALANINAL	V,Y,Z	2WDG	0.73
PHA	PHENYLALANINAL	V,Y,Z	2WDK	0.73
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	0.73
PHA	PHENYLALANINAL	P	3SGA	0.73
PHA	PHENYLALANINAL	A,B,C,D,E,F	1OB5	0.73
PHA	PHENYLALANINAL	V,Y,Z	2WDM	0.73
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	0.73
PHA	PHENYLALANINAL	A,B	1KDV	0.73
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	0.73
PHA	PHENYLALANINAL	A,B	1KDY	0.73
PHA	PHENYLALANINAL	V,Y,Z	3FIC	0.73
PHA	PHENYLALANINAL	V,Y,Z	2WDH	0.73
PHA	PHENYLALANINAL	A,B	1KE2	0.73
271	N-methyl-1-phenylmethanamine	X	2RBT	0.74
DPK	DEPRENYL	A,B	2BYB	0.75
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.87
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.87
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.87
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.87
V35	D-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACID	B,C	2VGC	0.81
200	4-CHLORO-L-PHENYLALANINE	A,B	2AKW	0.76
C2B	1-(4-CHLOROPHENYL)METHANAMINE	D,H	2Q7Q	0.89
SRE	(1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine	A	3GWU	0.75
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.72
PDH	(2S)-2-AMINO-3-PHENYL-1-PROPANOL	A	1GQ0	0.73
PHL	L-PHENYLALANINOL	A,B	1JOH	0.73
PHL	L-PHENYLALANINOL	I	3APR	0.73
PHL	L-PHENYLALANINOL	A	1DLZ	0.73
PHL	L-PHENYLALANINOL	A	1IH9	0.73
PHL	L-PHENYLALANINOL	A	1OB4	0.73
PHL	L-PHENYLALANINOL	I	2ER6	0.73
PHL	L-PHENYLALANINOL	A	1R9U	0.73
PHL	L-PHENYLALANINOL	A	1OB7	0.73
PHL	L-PHENYLALANINOL	A,B	1OB6	0.73
PHL	L-PHENYLALANINOL	A,B,C	1AMT	0.73
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.75
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
GB5	(2E)-3-(4-CHLOROPHENYL)-N-HYDROXYACRYLAMIDE	A,B	2ILP	0.73
NFA	PHENYLALANINE AMIDE	A,B,C,D	2BTJ	0.73
NFA	PHENYLALANINE AMIDE	A,B,C,D,E,F	2EFX	0.73
NFA	PHENYLALANINE AMIDE	A,B,C,D	2VVJ	0.73
NFA	PHENYLALANINE AMIDE	A	2A4O	0.73
NFA	PHENYLALANINE AMIDE	A,B	1XAE	0.73
NFA	PHENYLALANINE AMIDE	A,B,C,D	2OGR	0.73
NFA	PHENYLALANINE AMIDE	A,B,C,D	1QA7	0.73
NFA	PHENYLALANINE AMIDE	A,B,C,D	2GW4	0.73
CLD	D-PARA-CHLOROPHENYL-1-ACTEAMIDOBORONIC ACID ALANINE	A	1AVT	0.71
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.8
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.8
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.8
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.8
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.8