Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00340349

Ligand	Ligand name	Chain	PDB	Tanimoto
IQU	N-(2-AMINOETHYL)ISOQUINOLINE-5-SULFONAMIDE	A,B,C,D	2CKE	0.7
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T	1UW6	0.83
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.83
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.83
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.78
NTN	ISONICOTINAMIDINE	A	7ADH	0.79
PHN	1,10-PHENANTHROLINE	A	1LIH	0.73
PHN	1,10-PHENANTHROLINE	A	2LIG	0.73
PHN	1,10-PHENANTHROLINE	A,B	2FU7	0.73
278	1-(1-methyl-1H-pyrrol-2-yl)methanamine	X	2RBV	0.9
BP5	3-(2,2'-BIPYRIDIN-5-YL)-L-ALANINE	A	2PXH	0.71
HLO	1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM	A,B	2JEY	0.71
HLO	1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM	A,B	2JEZ	0.71
RBU		A,B	1BEX	0.74
DPT	4,7-DIMETHYL-[1,10]PHENANTHROLINE	A,B	1I53	0.72
QYT	(5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE-2,4-DIONE	A	2A5U	0.71
OBI	1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME	A,B	2GYW	0.74
LTN	L-TRYPTOPHANAMIDE	A	1MAU	0.71
LTN	L-TRYPTOPHANAMIDE	A,B	2QUI	0.71
9DA	9-DEAZAADENINE	A	1L1R	0.74
9DA	9-DEAZAADENINE	A	1L1Q	0.74
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.91
SM5	(1E)-5-(1-piperidin-4-yl-3-pyridin-4-yl-1H-pyrazol-4-yl)-2,3-dihydro-1H-inden-1-one oxime	A,B	3D4Q	0.71
793	3-{[(1R)-1-phenylethyl]amino}-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione	A	3FPM	0.7
IND	INDOLE	A	1L4H	0.77
IND	INDOLE	A,B,G	1O7N	0.77
IND	INDOLE	A	185L	0.77
IND	INDOLE	A,B	1EG9	0.77
IND	INDOLE	A,B	1UUV	0.77
IND	INDOLE	A,C,E	2B24	0.77
IND	INDOLE	A,B,C,D,E,F	2P85	0.77
BVF	4-METHYLPYRIDIN-2-AMINE	A,B	3E67	0.76
BVF	4-METHYLPYRIDIN-2-AMINE	A	2EUT	0.76
LL1	3-pyridin-4-yl-1H-indazole	A	3DNE	0.73
MIL	MILRINONE	A,B	1TLM	0.74
34Q	(3R,4R)-4-(pyrrolidin-1-ylcarbonyl)-1-(quinoxalin-2-ylcarbonyl)pyrrolidin-3-amine	A	2RIP	0.71
SCE	3-methyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine	A	2R3H	0.75
047	1-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-1H-INDOL-3-YL]METHYL}METHANAMINE	A,B	2PJL	0.73
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B,D,H	2IUQ	0.77
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B	2FPB	0.77
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	D,H	2AGW	0.77
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A	2PQL	0.77
JNF	N-cyclohexyl-4-imidazo[1,2-a]pyridin-3-yl-N-methylpyrimidin-2-amine	A	3CGF	0.7
PYS	2-PYRIDINETHIOL	A,B	1CTE	0.76
PYS	2-PYRIDINETHIOL	A	2IPP	0.76
BZI	BENZIMIDAZOLE	A	1RYC	0.71
BZI	BENZIMIDAZOLE	A	1L5F	0.71
BZI	BENZIMIDAZOLE	A	1KXM	0.71
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.88
IM4	(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine	A,C,D,E	2ZJU	0.75
IM4	(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine	A,B,C,D	3C79	0.75
2AP	2-AMINOPYRIDINE	A	1AEO	0.78
M2C	(2S)-2-AMINO-4-(METHYLSULFANYL)-1-PYRIDIN-2-YLBUTANE-1,1-DIOL	A	1QXY	0.71
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.73
HDU	N-[4-(2-METHYLIMIDAZO[1,2-A]PYRIDIN-3-YL)-2-PYRIMIDINYL]ACETAMIDE	A	1OIQ	0.72
JI1	3-({(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}amino)propan-1-ol	A,B	3B3M	0.72
PY2	3-(MERCAPTOMETHYLENE)PYRIDINE	A,B	1IDA	0.75
C4E	N-phenyl-1H-pyrrolo[2,3-b]pyridin-3-amine	A,B,C,D	3C4E	0.7
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2WHQ	0.72
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2WHP	0.72
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2GYU	0.72
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2GYV	0.81
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2JF0	0.81
NI9	3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM	A	2OPM	0.72
NI9	3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM	A,B	3DYF	0.72
NI9	3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM	A,B	3DYG	0.72
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.71
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D	2RFQ	0.77
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D,E,F	2GA4	0.77
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D,E,F	1R4P	0.77
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.75
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.78
PIM	4-PHENYL-1H-IMIDAZOLE	A,B	2D0T	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A	1E9X	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHD	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A,B,C,D	2RFC	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A	1ODO	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A	3E5K	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHE	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A,B	1F4T	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A	1S1F	0.74
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHF	0.74
SB9	HYDROXY[3-(6-METHYLPYRIDIN-2-YL)PROPYL]FORMAMIDE	P	2AIE	0.74
8IP	N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE-2,3-DIAMINE	A	2OHR	0.73
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.85
245	1-(2-chloropyridin-4-yl)-3-phenylurea	A	2QKN	0.74
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.77
1BY	[2-(PYRIDIN-2-YLAMINO)ETHANE-1,1-DIYL]BIS(PHOSPHONIC ACID)	A,B	2I19	0.73
GVH	1H-PYRROLO[2,3-B]PYRIDINE	A	2UVX	0.7
460	2-[5-(6-METHYLPYRIDIN-2-YL)-2,3-DIHYDRO-1H-PYRAZOL-4-YL]-1,5-NAPHTHYRIDINE	A	1VJY	0.75
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.76
6IP	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE	A	2OHP	0.72
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNF	0.73
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2H9V	0.73
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A,B	2ETR	0.73
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNJ	0.73
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	1Q8T	0.73
SB4	4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE	A	1BL7	0.71
SB4	4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE	A	3ERK	0.71
C48	N1-(1-DIMETHYLCARBAMOYL-2-PHENYL-ETHYL)-2-OXO-N4-(2-PYRIDIN-2-YL-ETHYL)-SUCCINAMIDE	A	1CVZ	0.72
FPH	3-(4-FLUOROPHENYL)-2-PYRIDIN-4-YL-1H-PYRROLO[3,2-B]PYRIDIN-1-OL	A	1OZ1	0.7
DA1	PYRIDINE-2,5-DIAMINE	A	2AQD	0.81
PIQ	2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE	A,B	2QXM	0.71
PIQ	2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE	A	1HZ0	0.71
3AP	3-AMINOPYRIDINE	A	1AEF	0.87
PPX	[PHENYLALANINYL-PROLINYL]-[2-(PYRIDIN-4-YLAMINO)-ETHYL]-AMINE	E,H	1QBV	0.73
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.94
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.94
JI2	N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine	A,B	3B3N	0.77
JI2	N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine	A,B	3DQR	0.77
1CM	(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE	A	2CI0	0.7
246	1-benzyl-3-(2-chloropyridin-4-yl)urea	A	2QPM	0.71
GG5	4-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]PYRIDINE	A	3HVC	0.74
MPI	IMIDAZO[1,2-A]PYRIDINE	A	1AEM	0.74
D4G		A,B,C,D	2FDY	0.76
LG4	5-METHYLPYRIDIN-2-AMINE	A	2EUP	0.76
CLQ	N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE	A	1CET	0.72
C53	2-IMINO-5-(1-PYRIDIN-2-YL-METH-(E)-YLIDENE)-1,3-THIAZOLIDIN-4-ONE	A	2V0D	0.8
EPJ	EPIBATIDINE	A,B,C,D,E	2BYQ	0.77
SPY	4-HYDROSULFONYLPYRIDINE	A,B	1IDB	0.73
4AP	4-AMINOPYRIDINE	A	1AEG	0.84
LIG	3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-.C.]PYRAZOLE	P	1JVP	0.71
RW1	4-phenylpyrimidine	A,B,C	3B9S	0.71
PY1	4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-YL)QUINOLINE	A	1PY5	0.71
SB6	4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE	A	1BL6	0.71
IQS	N-[2-(METHYLAMINO)ETHYL]-5-ISOQUINOLINESULFONAMIDE	E	1YDS	0.71
26D	PYRIDINE-2,6-DIAMINE	A	2ANZ	0.71
CDA	2-(6-CHLORO-3-{[2,2-DIFLUORO-2-(2-PYRIDINYL)ETHYL]AMINO}-2-OXO-1(2H)-PYRAZINYL)-N-[(2-FLUORO-6-PYRIDINYL)METHYL]ACETAMIDE	B,C	1MU6	0.74
ISQ	ISOQUINOLINE	A	1GDK	0.73
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGY	0.77
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AH0	0.77
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGX	0.77
3MP	3-METHYLPYRIDINE	A	1EUB	0.79
3MP	3-METHYLPYRIDINE	A	1BM6	0.79
CII	N-[(1S)-2-methyl-1-(pyridin-4-ylcarbamoyl)propyl]cyclohexanecarboxamide	A	2W0A	0.73