Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02844914

Ligand	Ligand name	Chain	PDB	Tanimoto
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.95
DPK	DEPRENYL	A,B	2BYB	0.95
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.9
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.9
271	N-methyl-1-phenylmethanamine	X	2RBT	0.88
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.87
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.86
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.85
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.84
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.84
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.84
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine	A	2JJG	0.84
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.83
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.83
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.83
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.83
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.83
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.83
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.83
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.83
ABN	BENZYLAMINE	D,H	2HXC	0.82
ABN	BENZYLAMINE	A,I	1A86	0.82
ABN	BENZYLAMINE	A	1UTN	0.82
ABN	BENZYLAMINE	A	1N6X	0.82
ABN	BENZYLAMINE	A	2BZA	0.82
ABN	BENZYLAMINE	A	2EUS	0.82
ABN	BENZYLAMINE	A	1N6Y	0.82
ABN	BENZYLAMINE	A	1UTJ	0.82
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.82
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.82
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.81
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.8
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.8
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.8
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.8
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.8
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.8
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.8
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.8
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.8
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.8
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.79
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.79
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.79
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.79
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.79
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.79
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.79
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.79
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.78
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.78
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.78
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.78
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.78
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.78
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.78
MBH	1-BENZYL-1-METHYL-1-(2-ACETYL)HYDRAZINIUM ION	A	1BMA	0.77
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.77
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N-DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.77
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.77
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.77
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.76
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A	2AI7	0.76
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A,B,C	2AI8	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.76
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.76
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.75
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.75
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.75
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.75
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.75
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.75
FPR	PROPYLBENZENE	C	1RHK	0.74
PRY	2-PROPYL-ANILINE	A	1OWY	0.74
N4B	N-BUTYLBENZENE	A	186L	0.74
PYL	PHENYLETHANE	C	1B07	0.74
PYL	PHENYLETHANE	A,B	2VRM	0.74
PYL	PHENYLETHANE	A	1NHB	0.74
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.74
CPU		A,B	1CR6	0.73
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.73
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE-1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2P1C	0.73
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE-1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2Z7H	0.73
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.72
I4B	ISOBUTYLBENZENE	A	184L	0.72
PXY	PARA-XYLENE	A	187L	0.72
PXY	PARA-XYLENE	A	225L	0.72
34A	3,4-DIMETHYLANILINE	A	1L4K	0.72
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.72
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.72
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.72
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.72
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.72
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.72
OXE	ORTHO-XYLENE	A,B	3E0X	0.72
OXE	ORTHO-XYLENE	A	188L	0.72
DP4	TRANS-2-(DIMETHYLPHENYLSILYL)-PIPERIDINE-N-OXIDE	A,B,C,D,E,F,G,H	1ND0	0.72
C2A	1-(3-CHLOROPHENYL)METHANAMINE	B,I	2C8Z	0.72
C2B	1-(4-CHLOROPHENYL)METHANAMINE	D,H	2Q7Q	0.72
PHM	PHENYLALANYLMETHANE	A,I	1PJP	0.72
PHM	PHENYLALANYLMETHANE	A,B,C	2J9J	0.72
PHM	PHENYLALANYLMETHANE	A,B,C	2JE4	0.72
BAM	BENZAMIDINE	U	1F5K	0.71
BAM	BENZAMIDINE	X	2BY8	0.71
BAM	BENZAMIDINE	B	2PSM	0.71
BAM	BENZAMIDINE	X	2BY9	0.71
BAM	BENZAMIDINE	A	1C1N	0.71
BAM	BENZAMIDINE	X	2BY6	0.71
BAM	BENZAMIDINE	H,I	1C5O	0.71
BAM	BENZAMIDINE	A	1XX4	0.71
BAM	BENZAMIDINE	A	1HJ8	0.71
BAM	BENZAMIDINE	A	1C5P	0.71
BAM	BENZAMIDINE	B	1C5Z	0.71
BAM	BENZAMIDINE	A,B	1ZVW	0.71
BAM	BENZAMIDINE	A	2ANW	0.71
BAM	BENZAMIDINE	A	2ANY	0.71
BAM	BENZAMIDINE	X	2BYA	0.71
BAM	BENZAMIDINE	A	1TIO	0.71
BAM	BENZAMIDINE	X	2BY5	0.71
BAM	BENZAMIDINE	X	2BY7	0.71
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.71
MN2	1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE	N	1NLO	0.71
SAF	3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL	A	1GQR	0.71
SAF	3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL	A	1GQS	0.71
SP9	N-{(1R)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNT	0.71
MGR	MALACHITE GREEN	A,B	3BQZ	0.71
MGR	MALACHITE GREEN	A	1Q8N	0.71
MGR	MALACHITE GREEN	A,B	3BR0	0.71
MGR	MALACHITE GREEN	A,D,E	3BTL	0.71
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.71
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.71
BEN	BENZAMIDINE	A	2TIO	0.71
BEN	BENZAMIDINE	A	1J15	0.71
BEN	BENZAMIDINE	A,B	3BEU	0.71
BEN	BENZAMIDINE	T	1V2U	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF8	0.71
BEN	BENZAMIDINE	A	1S0R	0.71
BEN	BENZAMIDINE	A,B	1V16	0.71
BEN	BENZAMIDINE	A	1CC7	0.71
BEN	BENZAMIDINE	A	3BG8	0.71
BEN	BENZAMIDINE	A	1CC8	0.71
BEN	BENZAMIDINE	A	3PTB	0.71
BEN	BENZAMIDINE	A,B	1TRM	0.71
BEN	BENZAMIDINE	A	1ZHR	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	1NKZ	0.71
BEN	BENZAMIDINE	A	2BLV	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLP	0.71
BEN	BENZAMIDINE	H,I	3D49	0.71
BEN	BENZAMIDINE	H,L,T	2AER	0.71
BEN	BENZAMIDINE	A	1J14	0.71
BEN	BENZAMIDINE	A	1NSA	0.71
BEN	BENZAMIDINE	A	2AYW	0.71
BEN	BENZAMIDINE	A	1BRA	0.71
BEN	BENZAMIDINE	A,B,C,D	1A0J	0.71
BEN	BENZAMIDINE	B,C,D	2AST	0.71
BEN	BENZAMIDINE	A,B	2CKR	0.71
BEN	BENZAMIDINE	A	1LPU	0.71
BEN	BENZAMIDINE	A	1ZHM	0.71
BEN	BENZAMIDINE	A	1J8A	0.71
BEN	BENZAMIDINE	A,B	3BCX	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF9	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3D04	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLL	0.71
BEN	BENZAMIDINE	A	1AND	0.71
BEN	BENZAMIDINE	A	2TBS	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP2	0.71
BEN	BENZAMIDINE	T	1V2M	0.71
BEN	BENZAMIDINE	A	2EEK	0.71
BEN	BENZAMIDINE	H,I	2ZI2	0.71
BEN	BENZAMIDINE	T	1V2J	0.71
BEN	BENZAMIDINE	H	1KLI	0.71
BEN	BENZAMIDINE	A	1CE5	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3B7J	0.71
BEN	BENZAMIDINE	B,Y	2PKA	0.71
BEN	BENZAMIDINE	A	2VJ0	0.71
BEN	BENZAMIDINE	A	3B3J	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOY	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP3	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLM	0.71
BEN	BENZAMIDINE	A	1ANB	0.71
BEN	BENZAMIDINE	A	1LO6	0.71
BEN	BENZAMIDINE	A	1LR4	0.71
BEN	BENZAMIDINE	A,B	1V1M	0.71
BEN	BENZAMIDINE	A	1ZHP	0.71
BEN	BENZAMIDINE	A	2J9N	0.71
BEN	BENZAMIDINE	A	2BMV	0.71
BEN	BENZAMIDINE	A,B	2CKS	0.71
BEN	BENZAMIDINE	A	2BLW	0.71
BEN	BENZAMIDINE	A	1J16	0.71
BEN	BENZAMIDINE	A,B	1V11	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP0	0.71
BEN	BENZAMIDINE	B	1RTF	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP1	0.71
BEN	BENZAMIDINE	A,B,C,D	2E58	0.71
BEN	BENZAMIDINE	A	2TRM	0.71
BEN	BENZAMIDINE	T	1V2V	0.71
BEN	BENZAMIDINE	A	1MBQ	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOZ	0.71
BEN	BENZAMIDINE	A	2O8U	0.71
BEN	BENZAMIDINE	H	1DWB	0.71
BEN	BENZAMIDINE	B,C	2ASS	0.71
BEN	BENZAMIDINE	A	1ANE	0.71
BEN	BENZAMIDINE	H,I	2ZIQ	0.71
BEN	BENZAMIDINE	A	1BIT	0.71
BEN	BENZAMIDINE	A	2AIQ	0.71
BEN	BENZAMIDINE	A	2OQ5	0.71
BEN	BENZAMIDINE	A	1ANC	0.71
BEN	BENZAMIDINE	H	1JBU	0.71
BEN	BENZAMIDINE	A,B	2BPQ	0.71
BEN	BENZAMIDINE	A,B,C,D	2GNN	0.71
BEN	BENZAMIDINE	T	1V2S	0.71
BEN	BENZAMIDINE	A	1H4W	0.71
BEN	BENZAMIDINE	A	1OSS	0.71
BEN	BENZAMIDINE	A	1W80	0.71
BEN	BENZAMIDINE	A	1BTY	0.71
BEN	BENZAMIDINE	H,I	2ZFQ	0.71
BEN	BENZAMIDINE	A	1EAX	0.71
BEN	BENZAMIDINE	A	1L2E	0.71
BEN	BENZAMIDINE	A	1WRI	0.71
BEN	BENZAMIDINE	A,B	3BB8	0.71
BEN	BENZAMIDINE	A	2OXS	0.71
BEN	BENZAMIDINE	A	1DPO	0.71
BEN	BENZAMIDINE	T	1V2L	0.71
MBN	TOLUENE	A,B	3D7O	0.71
MBN	TOLUENE	A,B	1R1X	0.71
MBN	TOLUENE	A,B	1JLX	0.71
MBN	TOLUENE	A,B,C,D	3D17	0.71
MBN	TOLUENE	A,B	2VRL	0.71
MBN	TOLUENE	A,I	2Z3E	0.71
MBN	TOLUENE	A,B	1YZI	0.71
MBN	TOLUENE	A,B	2DN1	0.71
MBN	TOLUENE	A,B	3EN1	0.71
PSS	ETHYLAMINOBENZYLMETHYLCARBONYL GROUP	A	1EAG	0.71
SP8	N-{(1S)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNS	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	0.7
HPQ	HOMOPHENYLALANINYLMETHANE	B	1EWP	0.7
F1H	N-(1-benzylpiperidin-4-yl)-4-sulfanylbutanamide	A	2ZJH	0.7
IDM	INDOLINE	A,B	3CEP	0.7
IDM	INDOLINE	A	1AEK	0.7
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.7
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.7
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.7
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.7
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.7