Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03817416

Ligand	Ligand name	Chain	PDB	Tanimoto
NI9	3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM	A	2OPM	0.75
NI9	3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM	A,B	3DYF	0.75
NI9	3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM	A,B	3DYG	0.75
793	3-{[(1R)-1-phenylethyl]amino}-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione	A	3FPM	0.75
PPX	[PHENYLALANINYL-PROLINYL]-[2-(PYRIDIN-4-YLAMINO)-ETHYL]-AMINE	E,H	1QBV	0.71
NCA	NICOTINAMIDE	A,B	2E5D	0.73
NCA	NICOTINAMIDE	A,B,C,D	2Z77	0.73
NCA	NICOTINAMIDE	A,B	1DMA	0.73
NCA	NICOTINAMIDE	A,B	1ISM	0.73
NCA	NICOTINAMIDE	A,B	1YC5	0.73
NCA	NICOTINAMIDE	A	2ZB7	0.73
NCA	NICOTINAMIDE	A,B,C,D,E,F,G,H	1R15	0.73
NCA	NICOTINAMIDE	A,B	2QQG	0.73
NCA	NICOTINAMIDE	A	2OTV	0.73
NCA	NICOTINAMIDE	A	2QHF	0.73
NCA	NICOTINAMIDE	A,B,C,D	2C8A	0.73
NCA	NICOTINAMIDE	A,B	2HJH	0.73
NCA	NICOTINAMIDE	A	2A15	0.73
NCA	NICOTINAMIDE	A	2R6V	0.73
NCA	NICOTINAMIDE	A,B	1ISI	0.73
NCA	NICOTINAMIDE	A,D,E	2R9J	0.73
NCA	NICOTINAMIDE	A	2H4J	0.73
NCA	NICOTINAMIDE	A,B	2OD9	0.73
NCA	NICOTINAMIDE	A,B,C,D,E	1YC2	0.73
NCA	NICOTINAMIDE	A,B	3DZG	0.73
NCA	NICOTINAMIDE	A	1OJU	0.73
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D	2RFQ	0.79
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D,E,F	2GA4	0.79
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D,E,F	1R4P	0.79
278	1-(1-methyl-1H-pyrrol-2-yl)methanamine	X	2RBV	0.83
PY2	3-(MERCAPTOMETHYLENE)PYRIDINE	A,B	1IDA	0.78
26D	PYRIDINE-2,6-DIAMINE	A	2ANZ	0.73
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.7
CM9	CIS-4-METHYL-N-[(1S)-3-(METHYLSULFANYL)-1-(PYRIDIN-4-YLCARBAMOYL)PROPYL]CYCLOHEXANECARBOXAMIDE	A	2W09	0.71
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A,B,C,D	1W6F	0.73
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2V2E	0.73
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	X	2VCF	0.73
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2VCS	0.73
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2VCN	0.73
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A,B	1XR3	0.73
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.7
K27	4-carbamoyl-1-(3-{4-[(E)-(hydroxyimino)methyl]pyridinium-1-yl}propyl)pyridinium	A,B	2WHR	0.72
PAA	(N-METHYLPYRIDYL)ACETIC ACID	I	1HBT	0.71
246	1-benzyl-3-(2-chloropyridin-4-yl)urea	A	2QPM	0.74
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
1CM	(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE	A	2CI0	0.76
245	1-(2-chloropyridin-4-yl)-3-phenylurea	A	2QKN	0.79
NTN	ISONICOTINAMIDINE	A	7ADH	0.82
460	2-[5-(6-METHYLPYRIDIN-2-YL)-2,3-DIHYDRO-1H-PYRAZOL-4-YL]-1,5-NAPHTHYRIDINE	A	1VJY	0.71
BVF	4-METHYLPYRIDIN-2-AMINE	A,B	3E67	0.81
BVF	4-METHYLPYRIDIN-2-AMINE	A	2EUT	0.81
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.88
2AP	2-AMINOPYRIDINE	A	1AEO	0.78
3AP	3-AMINOPYRIDINE	A	1AEF	0.85
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.74
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	0.81
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.81
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.81
LG4	5-METHYLPYRIDIN-2-AMINE	A	2EUP	0.8
C53	2-IMINO-5-(1-PYRIDIN-2-YL-METH-(E)-YLIDENE)-1,3-THIAZOLIDIN-4-ONE	A	2V0D	0.71
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.7
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.85
THA	TACRINE	A,B	2AOW	0.7
THA	TACRINE	A,B,C,D,E,F	1MX1	0.7
THA	TACRINE	A,B	2AOX	0.7
THA	TACRINE	A	1ACJ	0.7
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.73
LL1	3-pyridin-4-yl-1H-indazole	A	3DNE	0.71
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.78
DEQ	DEQUALINIUM	A,B,D,E	1JT6	0.72
DEQ	DEQUALINIUM	A,B,D,E	3BR2	0.72
DEQ	DEQUALINIUM	A	1OYD	0.72
DEQ	DEQUALINIUM	A,B,D,E	3BT9	0.72
DEQ	DEQUALINIUM	A,B,D,E	3BTJ	0.72
DEQ	DEQUALINIUM	A,B,D,E	3BR1	0.72
MIL	MILRINONE	A,B	1TLM	0.76
PY7	PYRIDIN-4-YLMETHANOL	A	2EUR	0.71
SPY	4-HYDROSULFONYLPYRIDINE	A,B	1IDB	0.77
3MP	3-METHYLPYRIDINE	A	1EUB	0.83
3MP	3-METHYLPYRIDINE	A	1BM6	0.83
CLQ	N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE	A	1CET	0.73
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.9
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNF	0.77
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2H9V	0.77
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A,B	2ETR	0.77
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNJ	0.77
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	1Q8T	0.77
4AP	4-AMINOPYRIDINE	A	1AEG	0.92
SB9	HYDROXY[3-(6-METHYLPYRIDIN-2-YL)PROPYL]FORMAMIDE	P	2AIE	0.72
DA1	PYRIDINE-2,5-DIAMINE	A	2AQD	0.82
OBI	1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME	A,B	2GYW	0.76
PYS	2-PYRIDINETHIOL	A,B	1CTE	0.78
PYS	2-PYRIDINETHIOL	A	2IPP	0.78
CII	N-[(1S)-2-methyl-1-(pyridin-4-ylcarbamoyl)propyl]cyclohexanecarboxamide	A	2W0A	0.75
RW1	4-phenylpyrimidine	A,B,C	3B9S	0.71
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.87
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.87
1BY	[2-(PYRIDIN-2-YLAMINO)ETHANE-1,1-DIYL]BIS(PHOSPHONIC ACID)	A,B	2I19	0.72
D4G		A,B,C,D	2FDY	0.79
ISQ	ISOQUINOLINE	A	1GDK	0.73
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.7