Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00448861

Ligand	Ligand name	Chain	PDB	Tanimoto
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.83
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.83
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.74
V36	L-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACID	B,C	1VGC	0.71
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.8
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.8
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.73
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.73
C2A	1-(3-CHLOROPHENYL)METHANAMINE	B,I	2C8Z	0.76
SRB	L-1-NAPHTHYL-2-ACETAMIDO-ETHANE BORONIC ACID	B,C	3VGC	0.72
MN2	1-CARBOXYETHYLAMINOMETHYL-4-AMINOMETHYLBENZENE	N	1NLO	0.8
MBH	1-BENZYL-1-METHYL-1-(2-ACETYL)HYDRAZINIUM ION	A	1BMA	0.78
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.83
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE-1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2P1C	0.71
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE-1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2Z7H	0.71
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.81
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.85
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.85
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.85
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.86
DP4	TRANS-2-(DIMETHYLPHENYLSILYL)-PIPERIDINE-N-OXIDE	A,B,C,D,E,F,G,H	1ND0	0.71
BEN	BENZAMIDINE	A	2TIO	0.72
BEN	BENZAMIDINE	A	1J15	0.72
BEN	BENZAMIDINE	A,B	3BEU	0.72
BEN	BENZAMIDINE	T	1V2U	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF8	0.72
BEN	BENZAMIDINE	A	1S0R	0.72
BEN	BENZAMIDINE	A,B	1V16	0.72
BEN	BENZAMIDINE	A	1CC7	0.72
BEN	BENZAMIDINE	A	3BG8	0.72
BEN	BENZAMIDINE	A	1CC8	0.72
BEN	BENZAMIDINE	A	3PTB	0.72
BEN	BENZAMIDINE	A,B	1TRM	0.72
BEN	BENZAMIDINE	A	1ZHR	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	1NKZ	0.72
BEN	BENZAMIDINE	A	2BLV	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLP	0.72
BEN	BENZAMIDINE	H,I	3D49	0.72
BEN	BENZAMIDINE	H,L,T	2AER	0.72
BEN	BENZAMIDINE	A	1J14	0.72
BEN	BENZAMIDINE	A	1NSA	0.72
BEN	BENZAMIDINE	A	2AYW	0.72
BEN	BENZAMIDINE	A	1BRA	0.72
BEN	BENZAMIDINE	A,B,C,D	1A0J	0.72
BEN	BENZAMIDINE	B,C,D	2AST	0.72
BEN	BENZAMIDINE	A,B	2CKR	0.72
BEN	BENZAMIDINE	A	1LPU	0.72
BEN	BENZAMIDINE	A	1ZHM	0.72
BEN	BENZAMIDINE	A	1J8A	0.72
BEN	BENZAMIDINE	A,B	3BCX	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF9	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3D04	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLL	0.72
BEN	BENZAMIDINE	A	1AND	0.72
BEN	BENZAMIDINE	A	2TBS	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP2	0.72
BEN	BENZAMIDINE	T	1V2M	0.72
BEN	BENZAMIDINE	A	2EEK	0.72
BEN	BENZAMIDINE	H,I	2ZI2	0.72
BEN	BENZAMIDINE	T	1V2J	0.72
BEN	BENZAMIDINE	H	1KLI	0.72
BEN	BENZAMIDINE	A	1CE5	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3B7J	0.72
BEN	BENZAMIDINE	B,Y	2PKA	0.72
BEN	BENZAMIDINE	A	2VJ0	0.72
BEN	BENZAMIDINE	A	3B3J	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOY	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP3	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLM	0.72
BEN	BENZAMIDINE	A	1ANB	0.72
BEN	BENZAMIDINE	A	1LO6	0.72
BEN	BENZAMIDINE	A	1LR4	0.72
BEN	BENZAMIDINE	A,B	1V1M	0.72
BEN	BENZAMIDINE	A	1ZHP	0.72
BEN	BENZAMIDINE	A	2J9N	0.72
BEN	BENZAMIDINE	A	2BMV	0.72
BEN	BENZAMIDINE	A,B	2CKS	0.72
BEN	BENZAMIDINE	A	2BLW	0.72
BEN	BENZAMIDINE	A	1J16	0.72
BEN	BENZAMIDINE	A,B	1V11	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP0	0.72
BEN	BENZAMIDINE	B	1RTF	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP1	0.72
BEN	BENZAMIDINE	A,B,C,D	2E58	0.72
BEN	BENZAMIDINE	A	2TRM	0.72
BEN	BENZAMIDINE	T	1V2V	0.72
BEN	BENZAMIDINE	A	1MBQ	0.72
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOZ	0.72
BEN	BENZAMIDINE	A	2O8U	0.72
BEN	BENZAMIDINE	H	1DWB	0.72
BEN	BENZAMIDINE	B,C	2ASS	0.72
BEN	BENZAMIDINE	A	1ANE	0.72
BEN	BENZAMIDINE	H,I	2ZIQ	0.72
BEN	BENZAMIDINE	A	1BIT	0.72
BEN	BENZAMIDINE	A	2AIQ	0.72
BEN	BENZAMIDINE	A	2OQ5	0.72
BEN	BENZAMIDINE	A	1ANC	0.72
BEN	BENZAMIDINE	H	1JBU	0.72
BEN	BENZAMIDINE	A,B	2BPQ	0.72
BEN	BENZAMIDINE	A,B,C,D	2GNN	0.72
BEN	BENZAMIDINE	T	1V2S	0.72
BEN	BENZAMIDINE	A	1H4W	0.72
BEN	BENZAMIDINE	A	1OSS	0.72
BEN	BENZAMIDINE	A	1W80	0.72
BEN	BENZAMIDINE	A	1BTY	0.72
BEN	BENZAMIDINE	H,I	2ZFQ	0.72
BEN	BENZAMIDINE	A	1EAX	0.72
BEN	BENZAMIDINE	A	1L2E	0.72
BEN	BENZAMIDINE	A	1WRI	0.72
BEN	BENZAMIDINE	A,B	3BB8	0.72
BEN	BENZAMIDINE	A	2OXS	0.72
BEN	BENZAMIDINE	A	1DPO	0.72
BEN	BENZAMIDINE	T	1V2L	0.72
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.84
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.84
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.84
CPU		A,B	1CR6	0.74
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.82
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.82
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.75
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.75
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.78
1MR	N-METHYLANILINE	X	2OTZ	0.72
PHM	PHENYLALANYLMETHANE	A,I	1PJP	0.71
PHM	PHENYLALANYLMETHANE	A,B,C	2J9J	0.71
PHM	PHENYLALANYLMETHANE	A,B,C	2JE4	0.71
SRD	D-1-NAPHTHYL-2-ACETAMIDO-ETHANE BORONIC ACID	B,C	4VGC	0.72
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.86
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.8
N2T	(2S)-4-(2,5-DIFLUOROPHENYL)-N-METHYL-2-PHENYL-N-PIPERIDIN-4-YL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FKY	0.73
PSS	ETHYLAMINOBENZYLMETHYLCARBONYL GROUP	A	1EAG	0.74
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.71
SP9	N-{(1R)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNT	0.76
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.93
C2B	1-(4-CHLOROPHENYL)METHANAMINE	D,H	2Q7Q	0.76
SKA	7,8-DICHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE	A,B	1YZ3	0.72
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.82
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.82
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.82
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.82
SKF	1,2,3,4-TETRAHYDRO-ISOQUINOLINE-7-SULFONIC ACID AMIDE	A,B	1HNN	0.72
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.76
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.72
PRY	2-PROPYL-ANILINE	A	1OWY	0.74
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.75
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.84
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.84
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A	2AI7	0.71
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A,B,C	2AI8	0.71
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.8
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
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.8
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-1-SULFONATE	A,B,C,D	1TP7	0.81
IDM	INDOLINE	A,B	3CEP	0.75
IDM	INDOLINE	A	1AEK	0.75
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.83
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.8
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.73
53U	D-phenylalanyl-N-benzyl-L-prolinamide	H,I	2ZFF	0.71
NYL	N-ALLYL-ANILINE	A	1OVK	0.74
SP8	N-{(1S)-3-[(4-aminobutyl)amino]-1-methylpropyl}benzamide	A,B	3CNS	0.76
BAM	BENZAMIDINE	U	1F5K	0.72
BAM	BENZAMIDINE	X	2BY8	0.72
BAM	BENZAMIDINE	B	2PSM	0.72
BAM	BENZAMIDINE	X	2BY9	0.72
BAM	BENZAMIDINE	A	1C1N	0.72
BAM	BENZAMIDINE	X	2BY6	0.72
BAM	BENZAMIDINE	H,I	1C5O	0.72
BAM	BENZAMIDINE	A	1XX4	0.72
BAM	BENZAMIDINE	A	1HJ8	0.72
BAM	BENZAMIDINE	A	1C5P	0.72
BAM	BENZAMIDINE	B	1C5Z	0.72
BAM	BENZAMIDINE	A,B	1ZVW	0.72
BAM	BENZAMIDINE	A	2ANW	0.72
BAM	BENZAMIDINE	A	2ANY	0.72
BAM	BENZAMIDINE	X	2BYA	0.72
BAM	BENZAMIDINE	A	1TIO	0.72
BAM	BENZAMIDINE	X	2BY5	0.72
BAM	BENZAMIDINE	X	2BY7	0.72
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.77
M25	N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE	A,B	2NMX	0.7
M25	N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE	A	2NNS	0.7
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY5	0.71
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY8	0.71
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY9	0.71
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XXZ	0.71
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY4	0.71
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY6	0.71
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.81
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.81
V35	D-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACID	B,C	2VGC	0.71
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.81
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.7
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.7
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.7
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.7
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.82
APE	(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACID	E,I	1SCN	0.73
LY1	8,9-DICHLORO-2,3,4,5-TETRAHYDRO-1H-BENZO[C]AZEPINE	A,B	1N7I	0.74
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N-DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.71
HDB	(R)-1-(4-(4-(HYDROXYMETHYL)-1,3,2-DIOXABOROLAN-2-YL)BENZYL)GUANIDINE	A	1ZMJ	0.71
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.82
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.82
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.82
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.82
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.83
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.83
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.83
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.83
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.83
ABN	BENZYLAMINE	D,H	2HXC	0.86
ABN	BENZYLAMINE	A,I	1A86	0.86
ABN	BENZYLAMINE	A	1UTN	0.86
ABN	BENZYLAMINE	A	1N6X	0.86
ABN	BENZYLAMINE	A	2BZA	0.86
ABN	BENZYLAMINE	A	2EUS	0.86
ABN	BENZYLAMINE	A	1N6Y	0.86
ABN	BENZYLAMINE	A	1UTJ	0.86
DPK	DEPRENYL	A,B	2BYB	0.86
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.71
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.71
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.71
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.71
F1K	(2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide	A,B,C	2ZJK	0.71
L18	(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine	A	2JJG	0.77
51U	D-phenylalanyl-N-(3-methylbenzyl)-L-prolinamide	H,I	2ZF0	0.7
RMA	N-[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]-N-METHYL-N-PROP-2-YNYLAMINE	A,B	1S3B	0.8
F1J	(2S)-4-(4-fluorobenzyl)-N-(2-sulfanylethyl)piperazine-2-carboxamide	A	2ZJJ	0.71
34A	3,4-DIMETHYLANILINE	A	1L4K	0.71
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.78
264	(phenylamino)acetonitrile	A	2RBN	0.72
F1H	N-(1-benzylpiperidin-4-yl)-4-sulfanylbutanamide	A	2ZJH	0.75
271	N-methyl-1-phenylmethanamine	X	2RBT	0.95
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.82
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.82
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