Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01397551

Ligand	Ligand name	Chain	PDB	Tanimoto
LA1	(2R)-2-[3-ISOBUTYL-2,5-DIOXO-4-(QUINOLIN-3-YLMETHYL)-1,4-DIAZEPAN-1-YL]-N-METHYL-3-(2-NAPHTHYL)PROPANAMIDE	A,B	1XUO	0.7
AYM	3-(6-AMINOPYRIDIN-3-YL)-N-METHYL-N-[(1-METHYL-1H-INDOL-2-YL)METHYL]ACRYLAMIDE	A,B	1LXC	0.73
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.71
K27	4-carbamoyl-1-(3-{4-[(E)-(hydroxyimino)methyl]pyridinium-1-yl}propyl)pyridinium	A,B	2WHR	0.7
793	3-{[(1R)-1-phenylethyl]amino}-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione	A	3FPM	0.73
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2WHQ	0.73
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2WHP	0.73
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2GYU	0.73
DPT	4,7-DIMETHYL-[1,10]PHENANTHROLINE	A,B	1I53	0.77
ISQ	ISOQUINOLINE	A	1GDK	0.71
SN6	1-METHYL-4-[4-[4-(4-(1-METHYLQUINOLINIUM)AMINO)BENZAMIDO]ANILINO]PYRIDINIUM	A,B	144D	0.72
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.76
34Q	(3R,4R)-4-(pyrrolidin-1-ylcarbonyl)-1-(quinoxalin-2-ylcarbonyl)pyrrolidin-3-amine	A	2RIP	0.82
CII	N-[(1S)-2-methyl-1-(pyridin-4-ylcarbamoyl)propyl]cyclohexanecarboxamide	A	2W0A	0.76
MIL	MILRINONE	A,B	1TLM	0.78
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.78
C53	2-IMINO-5-(1-PYRIDIN-2-YL-METH-(E)-YLIDENE)-1,3-THIAZOLIDIN-4-ONE	A	2V0D	0.77
8IP	N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE-2,3-DIAMINE	A	2OHR	0.71
9AD	9-AMINO-(N-(2-DIMETHYLAMINO)ETHYL)ACRIDINE-4-CARBOXAMIDE	A	465D	0.72
9AD	9-AMINO-(N-(2-DIMETHYLAMINO)ETHYL)ACRIDINE-4-CARBOXAMIDE	A	452D	0.72
I11	[[CYCLOHEXANESULFONYL-GLYCYL]-3[PYRIDIN-4-YL-AMINOMETHYL]ALANYL]PIPERIDINE	H	1UVS	0.71
A1E	(5R)-5-{[10-(1,2,3,4-TETRAHYDROACRIDIN-9-YLAMINO)DECYL]AMINO}-5,6,7,8-TETRAHYDROQUINOLIN-2(1H)-ONE	A	1ZGB	0.73
CNQ	3-(4-CHLOROPHENYL)QUINOXALINE-5-CARBOXAMIDE	A,B,C,D	1WOK	0.75
DA1	PYRIDINE-2,5-DIAMINE	A	2AQD	0.74
PHN	1,10-PHENANTHROLINE	A	1LIH	0.78
PHN	1,10-PHENANTHROLINE	A	2LIG	0.78
PHN	1,10-PHENANTHROLINE	A,B	2FU7	0.78
XR2	1-METHYL-9-[12-(9-METHYLPHENAZIN-10-IUM-1-YL)-12-OXO-2,11-DIAZA-5,8-DIAZONIADODEC-1-ANOYL]PHENAZIN-10-IUM	A	1X95	0.71
CLQ	N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE	A	1CET	0.71
N31	N-[3-(1H-benzimidazol-1-yl)propanoyl]glycyl-L-alanyl-L-alaninamide	A	3EXB	0.71
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.79
IQS	N-[2-(METHYLAMINO)ETHYL]-5-ISOQUINOLINESULFONAMIDE	E	1YDS	0.7
CDD	2-(6-CHLORO-3-{[2,2-DIFLUORO-2-(1-OXIDO-2-PYRIDINYL)ETHYL]AMINO}-2-OXO-1(2H)-PYRAZINYL)-N-[(2-FLUOROPHENYL)METHYL]ACETAMIDE	B,C	1MUE	0.72
55F	N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide	A,B,C,D,E	3FAA	0.72
246	1-benzyl-3-(2-chloropyridin-4-yl)urea	A	2QPM	0.72
BO2	N-[(1R)-1-(DIHYDROXYBORYL)-3-METHYLBUTYL]-N-(PYRAZIN-2-YLCARBONYL)-L-PHENYLALANINAMIDE	2,H,K,N,V,Y	2F16	0.73
3AP	3-AMINOPYRIDINE	A	1AEF	0.79
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.76
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.74
BFA	9-BROMO-PHENAZINE-1-CARBOXYLIC ACID (2-DIMETHYLAMINO-ETHYL)-AMIDE	A,B	1EG6	0.72
278	1-(1-methyl-1H-pyrrol-2-yl)methanamine	X	2RBV	0.73
245	1-(2-chloropyridin-4-yl)-3-phenylurea	A	2QKN	0.74
CM9	CIS-4-METHYL-N-[(1S)-3-(METHYLSULFANYL)-1-(PYRIDIN-4-YLCARBAMOYL)PROPYL]CYCLOHEXANECARBOXAMIDE	A	2W09	0.72
8ST	N-(4-chlorophenyl)-2-[(pyridin-4-ylmethyl)amino]benzamide	A	3HNG	0.7
460	2-[5-(6-METHYLPYRIDIN-2-YL)-2,3-DIHYDRO-1H-PYRAZOL-4-YL]-1,5-NAPHTHYRIDINE	A	1VJY	0.75
QUI	2-CARBOXYQUINOXALINE	A	1PFE	0.78
QUI	2-CARBOXYQUINOXALINE	A,B	2DA8	0.78
QUI	2-CARBOXYQUINOXALINE	A,C,E,G	2ADW	0.78
QUI	2-CARBOXYQUINOXALINE	A	1VS2	0.78
QUI	2-CARBOXYQUINOXALINE	A	1XVN	0.78
QUI	2-CARBOXYQUINOXALINE	A,B	185D	0.78
QUI	2-CARBOXYQUINOXALINE	A	1XVK	0.78
QUI	2-CARBOXYQUINOXALINE	A,C	1XVR	0.78
QUI	2-CARBOXYQUINOXALINE	A,B	3GO3	0.78
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.8
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.8
8AD	9-AMINO-(N-(2-DIMETHYLAMINO)BUTYL)ACRIDINE-4-CARBOXAMIDE	A,B	1FN2	0.7
8AD	9-AMINO-(N-(2-DIMETHYLAMINO)BUTYL)ACRIDINE-4-CARBOXAMIDE	A,B	1FN1	0.7
HLO	1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM	A,B	2JEY	0.72
HLO	1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM	A,B	2JEZ	0.72
PF7	4-(quinolin-3-ylmethyl)piperidine-1-carboxylic acid	A,B	2VYA	0.73
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNF	0.75
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2H9V	0.75
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A,B	2ETR	0.75
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNJ	0.75
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	1Q8T	0.75
P4O	2-(2-QUINOLIN-3-YLPYRIDIN-4-YL)-1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2-C]PYRIDIN-4-ONE	A	2JBO	0.71
P4O	2-(2-QUINOLIN-3-YLPYRIDIN-4-YL)-1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2-C]PYRIDIN-4-ONE	A,B,C,D,E,F,G,H,I,K,L	2JBP	0.71
1CM	(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE	A	2CI0	0.74
PPX	[PHENYLALANINYL-PROLINYL]-[2-(PYRIDIN-4-YLAMINO)-ETHYL]-AMINE	E,H	1QBV	0.73
3B3	(2S)-1-AMINO-3-[(5-NITROQUINOLIN-8-YL)AMINO]PROPAN-2-OL	A	2CGV	0.72
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.8
C92	N'-(6-aminopyridin-3-yl)-N-(2-cyclopentylethyl)-4-methyl-benzene-1,3-dicarboxamide	A,B	3CPB	0.71
NCA	NICOTINAMIDE	A,B	2E5D	0.71
NCA	NICOTINAMIDE	A,B,C,D	2Z77	0.71
NCA	NICOTINAMIDE	A,B	1DMA	0.71
NCA	NICOTINAMIDE	A,B	1ISM	0.71
NCA	NICOTINAMIDE	A,B	1YC5	0.71
NCA	NICOTINAMIDE	A	2ZB7	0.71
NCA	NICOTINAMIDE	A,B,C,D,E,F,G,H	1R15	0.71
NCA	NICOTINAMIDE	A,B	2QQG	0.71
NCA	NICOTINAMIDE	A	2OTV	0.71
NCA	NICOTINAMIDE	A	2QHF	0.71
NCA	NICOTINAMIDE	A,B,C,D	2C8A	0.71
NCA	NICOTINAMIDE	A,B	2HJH	0.71
NCA	NICOTINAMIDE	A	2A15	0.71
NCA	NICOTINAMIDE	A	2R6V	0.71
NCA	NICOTINAMIDE	A,B	1ISI	0.71
NCA	NICOTINAMIDE	A,D,E	2R9J	0.71
NCA	NICOTINAMIDE	A	2H4J	0.71
NCA	NICOTINAMIDE	A,B	2OD9	0.71
NCA	NICOTINAMIDE	A,B,C,D,E	1YC2	0.71
NCA	NICOTINAMIDE	A,B	3DZG	0.71
NCA	NICOTINAMIDE	A	1OJU	0.71
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2GYV	0.72
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2JF0	0.72
IHZ	5-[(2-methyl-5-{[3-(trifluoromethyl)phenyl]carbamoyl}phenyl)amino]pyridine-3-carboxamide	A	3DKO	0.72
RBS	N-(4-PHENYLAMINO-QUINAZOLIN-6-YL)-ACRYLAMIDE	A,B	2HWO	0.71
DGB	N-[4-(1-BENZOYLPIPERIDIN-4-YL)BUTYL]-3-PYRIDIN-3-YLPROPANAMIDE	A,B	2G97	0.75
DGB	N-[4-(1-BENZOYLPIPERIDIN-4-YL)BUTYL]-3-PYRIDIN-3-YLPROPANAMIDE	A,B	2GVJ	0.75
4AP	4-AMINOPYRIDINE	A	1AEG	0.74
QYT	(5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE-2,4-DIONE	A	2A5U	0.84
NPH	CYSTEINE-METHYLENE-CARBAMOYL-1,10-PHENANTHROLINE	A	1A18	0.72
7AD	9-AMINO-N-[3-(DIMETHYLAMINO)PROPYL]ACRIDINE-4-CARBOXAMIDE	A,B	1RQY	0.7
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
SB9	HYDROXY[3-(6-METHYLPYRIDIN-2-YL)PROPYL]FORMAMIDE	P	2AIE	0.7
C48	N1-(1-DIMETHYLCARBAMOYL-2-PHENYL-ETHYL)-2-OXO-N4-(2-PYRIDIN-2-YL-ETHYL)-SUCCINAMIDE	A	1CVZ	0.74
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A,B,C,D	1W6F	0.71
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2V2E	0.71
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	X	2VCF	0.71
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2VCS	0.71
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2VCN	0.71
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A,B	1XR3	0.71
PYA	3-(1,10-PHENANTHROL-2-YL)-L-ALANINE	A	1HCW	0.72
A2E	(5S)-5-{[10-(1,2,3,4-TETRAHYDROACRIDIN-9-YLAMINO)DECYL]AMINO}-5,6,7,8-TETRAHYDROQUINOLIN-2(1H)-ONE	A,B	1ZGC	0.73