Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01423531

Ligand	Ligand name	Chain	PDB	Tanimoto
PRY	2-PROPYL-ANILINE	A	1OWY	0.78
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2OUA	0.71
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B,C,D	2AJC	0.71
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	3PRO	0.71
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2PFE	0.71
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.73
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.78
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.78
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.78
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.78
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.78
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.78
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
OXE	ORTHO-XYLENE	A,B	3E0X	0.74
OXE	ORTHO-XYLENE	A	188L	0.74
BEN	BENZAMIDINE	A	2TIO	0.77
BEN	BENZAMIDINE	A	1J15	0.77
BEN	BENZAMIDINE	A,B	3BEU	0.77
BEN	BENZAMIDINE	T	1V2U	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF8	0.77
BEN	BENZAMIDINE	A	1S0R	0.77
BEN	BENZAMIDINE	A,B	1V16	0.77
BEN	BENZAMIDINE	A	1CC7	0.77
BEN	BENZAMIDINE	A	3BG8	0.77
BEN	BENZAMIDINE	A	1CC8	0.77
BEN	BENZAMIDINE	A	3PTB	0.77
BEN	BENZAMIDINE	A,B	1TRM	0.77
BEN	BENZAMIDINE	A	1ZHR	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	1NKZ	0.77
BEN	BENZAMIDINE	A	2BLV	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLP	0.77
BEN	BENZAMIDINE	H,I	3D49	0.77
BEN	BENZAMIDINE	H,L,T	2AER	0.77
BEN	BENZAMIDINE	A	1J14	0.77
BEN	BENZAMIDINE	A	1NSA	0.77
BEN	BENZAMIDINE	A	2AYW	0.77
BEN	BENZAMIDINE	A	1BRA	0.77
BEN	BENZAMIDINE	A,B,C,D	1A0J	0.77
BEN	BENZAMIDINE	B,C,D	2AST	0.77
BEN	BENZAMIDINE	A,B	2CKR	0.77
BEN	BENZAMIDINE	A	1LPU	0.77
BEN	BENZAMIDINE	A	1ZHM	0.77
BEN	BENZAMIDINE	A	1J8A	0.77
BEN	BENZAMIDINE	A,B	3BCX	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF9	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3D04	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLL	0.77
BEN	BENZAMIDINE	A	1AND	0.77
BEN	BENZAMIDINE	A	2TBS	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP2	0.77
BEN	BENZAMIDINE	T	1V2M	0.77
BEN	BENZAMIDINE	A	2EEK	0.77
BEN	BENZAMIDINE	H,I	2ZI2	0.77
BEN	BENZAMIDINE	T	1V2J	0.77
BEN	BENZAMIDINE	H	1KLI	0.77
BEN	BENZAMIDINE	A	1CE5	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3B7J	0.77
BEN	BENZAMIDINE	B,Y	2PKA	0.77
BEN	BENZAMIDINE	A	2VJ0	0.77
BEN	BENZAMIDINE	A	3B3J	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOY	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP3	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLM	0.77
BEN	BENZAMIDINE	A	1ANB	0.77
BEN	BENZAMIDINE	A	1LO6	0.77
BEN	BENZAMIDINE	A	1LR4	0.77
BEN	BENZAMIDINE	A,B	1V1M	0.77
BEN	BENZAMIDINE	A	1ZHP	0.77
BEN	BENZAMIDINE	A	2J9N	0.77
BEN	BENZAMIDINE	A	2BMV	0.77
BEN	BENZAMIDINE	A,B	2CKS	0.77
BEN	BENZAMIDINE	A	2BLW	0.77
BEN	BENZAMIDINE	A	1J16	0.77
BEN	BENZAMIDINE	A,B	1V11	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP0	0.77
BEN	BENZAMIDINE	B	1RTF	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP1	0.77
BEN	BENZAMIDINE	A,B,C,D	2E58	0.77
BEN	BENZAMIDINE	A	2TRM	0.77
BEN	BENZAMIDINE	T	1V2V	0.77
BEN	BENZAMIDINE	A	1MBQ	0.77
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOZ	0.77
BEN	BENZAMIDINE	A	2O8U	0.77
BEN	BENZAMIDINE	H	1DWB	0.77
BEN	BENZAMIDINE	B,C	2ASS	0.77
BEN	BENZAMIDINE	A	1ANE	0.77
BEN	BENZAMIDINE	H,I	2ZIQ	0.77
BEN	BENZAMIDINE	A	1BIT	0.77
BEN	BENZAMIDINE	A	2AIQ	0.77
BEN	BENZAMIDINE	A	2OQ5	0.77
BEN	BENZAMIDINE	A	1ANC	0.77
BEN	BENZAMIDINE	H	1JBU	0.77
BEN	BENZAMIDINE	A,B	2BPQ	0.77
BEN	BENZAMIDINE	A,B,C,D	2GNN	0.77
BEN	BENZAMIDINE	T	1V2S	0.77
BEN	BENZAMIDINE	A	1H4W	0.77
BEN	BENZAMIDINE	A	1OSS	0.77
BEN	BENZAMIDINE	A	1W80	0.77
BEN	BENZAMIDINE	A	1BTY	0.77
BEN	BENZAMIDINE	H,I	2ZFQ	0.77
BEN	BENZAMIDINE	A	1EAX	0.77
BEN	BENZAMIDINE	A	1L2E	0.77
BEN	BENZAMIDINE	A	1WRI	0.77
BEN	BENZAMIDINE	A,B	3BB8	0.77
BEN	BENZAMIDINE	A	2OXS	0.77
BEN	BENZAMIDINE	A	1DPO	0.77
BEN	BENZAMIDINE	T	1V2L	0.77
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.7
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.74
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.7
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.7
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.7
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.7
PYL	PHENYLETHANE	C	1B07	0.76
PYL	PHENYLETHANE	A,B	2VRM	0.76
PYL	PHENYLETHANE	A	1NHB	0.76
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.78
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.78
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.78
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.78
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.81
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.81
MBN	TOLUENE	A,B	3D7O	0.73
MBN	TOLUENE	A,B	1R1X	0.73
MBN	TOLUENE	A,B	1JLX	0.73
MBN	TOLUENE	A,B,C,D	3D17	0.73
MBN	TOLUENE	A,B	2VRL	0.73
MBN	TOLUENE	A,I	2Z3E	0.73
MBN	TOLUENE	A,B	1YZI	0.73
MBN	TOLUENE	A,B	2DN1	0.73
MBN	TOLUENE	A,B	3EN1	0.73
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.8
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.8
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.8
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.8
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.77
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.77
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.83
N4B	N-BUTYLBENZENE	A	186L	0.76
271	N-methyl-1-phenylmethanamine	X	2RBT	0.81
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.77
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.84
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.84
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.72
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.72
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.72
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.72
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.72
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.79
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.79
PXY	PARA-XYLENE	A	187L	0.76
PXY	PARA-XYLENE	A	225L	0.76
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.71
4BT	2-{2-[4-(2-CARBAMIMIDOYLSULFANYL-ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA	A,B	1D1X	0.7
DPK	DEPRENYL	A,B	2BYB	0.75
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.81
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.81
C2B	1-(4-CHLOROPHENYL)METHANAMINE	D,H	2Q7Q	0.74
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.78
BAM	BENZAMIDINE	U	1F5K	0.77
BAM	BENZAMIDINE	X	2BY8	0.77
BAM	BENZAMIDINE	B	2PSM	0.77
BAM	BENZAMIDINE	X	2BY9	0.77
BAM	BENZAMIDINE	A	1C1N	0.77
BAM	BENZAMIDINE	X	2BY6	0.77
BAM	BENZAMIDINE	H,I	1C5O	0.77
BAM	BENZAMIDINE	A	1XX4	0.77
BAM	BENZAMIDINE	A	1HJ8	0.77
BAM	BENZAMIDINE	A	1C5P	0.77
BAM	BENZAMIDINE	B	1C5Z	0.77
BAM	BENZAMIDINE	A,B	1ZVW	0.77
BAM	BENZAMIDINE	A	2ANW	0.77
BAM	BENZAMIDINE	A	2ANY	0.77
BAM	BENZAMIDINE	X	2BYA	0.77
BAM	BENZAMIDINE	A	1TIO	0.77
BAM	BENZAMIDINE	X	2BY5	0.77
BAM	BENZAMIDINE	X	2BY7	0.77
I4B	ISOBUTYLBENZENE	A	184L	0.76
ABN	BENZYLAMINE	D,H	2HXC	0.84
ABN	BENZYLAMINE	A,I	1A86	0.84
ABN	BENZYLAMINE	A	1UTN	0.84
ABN	BENZYLAMINE	A	1N6X	0.84
ABN	BENZYLAMINE	A	2BZA	0.84
ABN	BENZYLAMINE	A	2EUS	0.84
ABN	BENZYLAMINE	A	1N6Y	0.84
ABN	BENZYLAMINE	A	1UTJ	0.84
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.81
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.81
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.81
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.81
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.71
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.83
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.82
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.73
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.71
4CM	(4-CARBAMIMIDOYLPHENYL)-METHYL-PHOSPHINIC ACID	A	1TX7	0.7
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.72
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.72
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.72
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.71
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.71
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.71
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.71
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.77
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.71
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.73
FPR	PROPYLBENZENE	C	1RHK	0.76
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.72
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.72
2HT	3-methylbenzonitrile	A,B	3F88	0.71
34A	3,4-DIMETHYLANILINE	A	1L4K	0.76
ZYX	4-(2-AMINOETHYL)BENZENESULFONAMIDE	A	2NNG	0.71
PTF	[(METHYLSULFANYL)METHYL]BENZENE	C,F	1RHQ	0.71
C2A	1-(3-CHLOROPHENYL)METHANAMINE	B,I	2C8Z	0.74
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.81
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.81
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.81
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.81
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.81
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.81
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.81
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.81