Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00023150

Ligand	Ligand name	Chain	PDB	Tanimoto
246	1-benzyl-3-(2-chloropyridin-4-yl)urea	A	2QPM	0.75
26D	PYRIDINE-2,6-DIAMINE	A	2ANZ	0.74
NTN	ISONICOTINAMIDINE	A	7ADH	0.79
MIL	MILRINONE	A,B	1TLM	0.72
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.72
SCE	3-methyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine	A	2R3H	0.7
LL1	3-pyridin-4-yl-1H-indazole	A	3DNE	0.7
CII	N-[(1S)-2-methyl-1-(pyridin-4-ylcarbamoyl)propyl]cyclohexanecarboxamide	A	2W0A	0.71
RW1	4-phenylpyrimidine	A,B,C	3B9S	0.75
IND	INDOLE	A	1L4H	0.73
IND	INDOLE	A,B,G	1O7N	0.73
IND	INDOLE	A	185L	0.73
IND	INDOLE	A,B	1EG9	0.73
IND	INDOLE	A,B	1UUV	0.73
IND	INDOLE	A,C,E	2B24	0.73
IND	INDOLE	A,B,C,D,E,F	2P85	0.73
2AQ	QUINOLIN-2-AMINE	A	2OHL	0.7
GG5	4-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]PYRIDINE	A	3HVC	0.71
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2GYV	0.8
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2JF0	0.8
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B,D,H	2IUQ	0.73
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B	2FPB	0.73
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	D,H	2AGW	0.73
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A	2PQL	0.73
4AP	4-AMINOPYRIDINE	A	1AEG	0.83
1CM	(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE	A	2CI0	0.71
PYS	2-PYRIDINETHIOL	A,B	1CTE	0.76
PYS	2-PYRIDINETHIOL	A	2IPP	0.76
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.84
3MP	3-METHYLPYRIDINE	A	1EUB	0.77
3MP	3-METHYLPYRIDINE	A	1BM6	0.77
PY2	3-(MERCAPTOMETHYLENE)PYRIDINE	A,B	1IDA	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A,B	2D0T	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A	1E9X	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHD	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A,B,C,D	2RFC	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A	1ODO	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A	3E5K	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHE	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A,B	1F4T	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A	1S1F	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHF	0.71
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.73
JI2	N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine	A,B	3B3N	0.76
JI2	N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine	A,B	3DQR	0.76
C1D	1-(2-{[(6-AMINO-2-METHYLPYRIDIN-3-YL)METHYL]AMINO}ETHYL)-6-CHLORO-3-[(2,2-DIFLUORO-2-PYRIDIN-2-YLETHYL)AMINO]-1,4-DIHYDROPYRAZIN-2-OL	H,I	2BXU	0.71
C53	2-IMINO-5-(1-PYRIDIN-2-YL-METH-(E)-YLIDENE)-1,3-THIAZOLIDIN-4-ONE	A	2V0D	0.76
1BY	[2-(PYRIDIN-2-YLAMINO)ETHANE-1,1-DIYL]BIS(PHOSPHONIC ACID)	A,B	2I19	0.75
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.74
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNF	0.74
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2H9V	0.74
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A,B	2ETR	0.74
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNJ	0.74
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	1Q8T	0.74
ESP	THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE	B	1C5Y	0.7
ESP	THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE	A	1C5U	0.7
ESP	THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE	A	1C5T	0.7
CBQ	[(5-CHLORO-PYRIDIN-2-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID	A,B	1T1S	0.71
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.85
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.77
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGY	0.73
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AH0	0.73
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGX	0.73
HM2	5-CHLORO-6-METHYL-N-(2-PHENYLETHYL)-2-PYRIDIN-2-YLPYRIMIDIN-4-AMINE	A	2G6P	0.71
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.79
SB9	HYDROXY[3-(6-METHYLPYRIDIN-2-YL)PROPYL]FORMAMIDE	P	2AIE	0.73
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.85
6IP	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE	A	2OHP	0.72
IM4	(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine	A,C,D,E	2ZJU	0.71
IM4	(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine	A,B,C,D	3C79	0.71
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.74
M2C	(2S)-2-AMINO-4-(METHYLSULFANYL)-1-PYRIDIN-2-YLBUTANE-1,1-DIOL	A	1QXY	0.73
A8N	N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)-1,8-DIAMINOOCTANE	A	1UT6	0.7
8IP	N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE-2,3-DIAMINE	A	2OHR	0.74
EPJ	EPIBATIDINE	A,B,C,D,E	2BYQ	0.73
278	1-(1-methyl-1H-pyrrol-2-yl)methanamine	X	2RBV	0.78
793	3-{[(1R)-1-phenylethyl]amino}-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione	A	3FPM	0.71
BVF	4-METHYLPYRIDIN-2-AMINE	A,B	3E67	0.78
BVF	4-METHYLPYRIDIN-2-AMINE	A	2EUT	0.78
AS3	4-METHYL-6-PROPYLPYRIDIN-2-AMINE	A,B	3E6N	0.73
760	9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1DX4	0.7
9DA	9-DEAZAADENINE	A	1L1R	0.71
9DA	9-DEAZAADENINE	A	1L1Q	0.71
D4G		A,B,C,D	2FDY	0.76
JI1	3-({(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}amino)propan-1-ol	A,B	3B3M	0.71
CLQ	N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE	A	1CET	0.72
CK8	N-[4-(2,4-DIMETHYL-THIAZOL-5-YL)-PYRIMIDIN-2-YL]-N',N'-DIMETHYL-BENZENE-1,4-DIAMINE	A,C	2C5N	0.71
CK8	N-[4-(2,4-DIMETHYL-THIAZOL-5-YL)-PYRIMIDIN-2-YL]-N',N'-DIMETHYL-BENZENE-1,4-DIAMINE	A	1PXP	0.71
SPY	4-HYDROSULFONYLPYRIDINE	A,B	1IDB	0.73
3AP	3-AMINOPYRIDINE	A	1AEF	0.82
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	0.73
OBI	1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME	A,B	2GYW	0.71
PHN	1,10-PHENANTHROLINE	A	1LIH	0.71
PHN	1,10-PHENANTHROLINE	A	2LIG	0.71
PHN	1,10-PHENANTHROLINE	A,B	2FU7	0.71
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.88
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.88
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	0.78
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.78
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.78
245	1-(2-chloropyridin-4-yl)-3-phenylurea	A	2QKN	0.78
460	2-[5-(6-METHYLPYRIDIN-2-YL)-2,3-DIHYDRO-1H-PYRAZOL-4-YL]-1,5-NAPHTHYRIDINE	A	1VJY	0.72
RBU		A,B	1BEX	0.71
CK2	4-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)PYRIMIDIN-2-AMINE	A,C	2C5O	0.72
CK2	4-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)PYRIMIDIN-2-AMINE	A	1PXJ	0.72
ISQ	ISOQUINOLINE	A	1GDK	0.73
LG4	5-METHYLPYRIDIN-2-AMINE	A	2EUP	0.79
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.74
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D	2RFQ	0.75
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D,E,F	2GA4	0.75
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D,E,F	1R4P	0.75
CK3	N-[4-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)PYRIMIDIN-2-YL]-N'-HYDROXYIMIDOFORMAMIDE	A	1PXK	0.72
DA1	PYRIDINE-2,5-DIAMINE	A	2AQD	0.8
2AP	2-AMINOPYRIDINE	A	1AEO	0.81