Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00018772

Ligand	Ligand name	Chain	PDB	Tanimoto
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.79
ISQ	ISOQUINOLINE	A	1GDK	0.79
OBI	1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME	A,B	2GYW	0.75
9CA	9H-CARBAZOLE	A,B,C,D,E,F	2DE7	0.72
SB6	4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE	A	1BL6	0.74
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
IMQ	(2R,3R,4S)-2-(hydroxymethyl)-1-(quinolin-8-ylmethyl)pyrrolidine-3,4-diol	A,B	3EPX	0.71
THA	TACRINE	A,B	2AOW	0.71
THA	TACRINE	A,B,C,D,E,F	1MX1	0.71
THA	TACRINE	A,B	2AOX	0.71
THA	TACRINE	A	1ACJ	0.71
SCE	3-methyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine	A	2R3H	0.7
PRM	3,8-DIAMINO-5[3-(DIETHYLMETHYLAMMONIO)PROPYL]-6-PHENYLPHENANTHRIDINIUM	A,B	1N5R	0.7
RW1	4-phenylpyrimidine	A,B,C	3B9S	0.74
LG4	5-METHYLPYRIDIN-2-AMINE	A	2EUP	0.75
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.78
NTN	ISONICOTINAMIDINE	A	7ADH	0.76
2MI	2-METHYL-1H-INDOLE	A	2PIO	0.77
LIG	3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-.C.]PYRAZOLE	P	1JVP	0.73
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.82
PAA	(N-METHYLPYRIDYL)ACETIC ACID	I	1HBT	0.71
3IB	3-INDOLEBUTYRIC ACID	A,B	2AY6	0.71
3IB	3-INDOLEBUTYRIC ACID	A,B,C,E	2GJ6	0.71
23M	2-(3-METHYLPHENYL)-1H-INDOLE-5-CARBOXIMIDAMIDE	A	2G5N	0.71
C8C	2-amino-6-[2-(1H-indol-6-yl)ethyl]pyrimidin-4(3H)-one	A	2VA5	0.7
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.75
PRL	PROFLAVIN	H,I	1BCU	0.7
PRL	PROFLAVIN	A,B,D,E	1QVT	0.7
PRL	PROFLAVIN	A,B	2KD4	0.7
PRL	PROFLAVIN	A	1QVU	0.7
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.74
760	9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1DX4	0.71
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGY	0.81
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AH0	0.81
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGX	0.81
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.8
PIU	1-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}-2,4,6-TRIMETHYLPYRIDINIUM	A	1ZE8	0.72
TPL	TRYPTOPHANOL	A	1EE7	0.72
AYM	3-(6-AMINOPYRIDIN-3-YL)-N-METHYL-N-[(1-METHYL-1H-INDOL-2-YL)METHYL]ACRYLAMIDE	A,B	1LXC	0.72
TSC	(1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL	D,H	2AH0	0.71
TSC	(1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL	D,H	2AGZ	0.71
PIQ	2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE	A,B	2QXM	0.73
PIQ	2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE	A	1HZ0	0.73
LL1	3-pyridin-4-yl-1H-indazole	A	3DNE	0.74
PY1	4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-YL)QUINOLINE	A	1PY5	0.7
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.87
TH4	{(2Z)-3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene}cyanamide	A,B,C,D,E	3C84	0.71
3AP	3-AMINOPYRIDINE	A	1AEF	0.73
251	N-[amino(imino)methyl]-2-(2,5-diphenyl-1H-pyrrol-1-yl)acetamide	A	2QU2	0.72
MR3	1-METHYL-1H-PYRROLE	X	2OU0	0.73
GW3	7-(1-ETHYL-PROPYL)-7H-PYRROLO-[3,2-F]QUINAZOLINE-1,3-DIAMINE	A,B	1AOE	0.7
PY2	3-(MERCAPTOMETHYLENE)PYRIDINE	A,B	1IDA	0.79
C53	2-IMINO-5-(1-PYRIDIN-2-YL-METH-(E)-YLIDENE)-1,3-THIAZOLIDIN-4-ONE	A	2V0D	0.71
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.81
KSL	N-(2,6-dimethylphenyl)-5-phenylimidazo[1,5-a]pyrazin-8-amine	A	2ZYB	0.7
PPX	[PHENYLALANINYL-PROLINYL]-[2-(PYRIDIN-4-YLAMINO)-ETHYL]-AMINE	E,H	1QBV	0.7
BVF	4-METHYLPYRIDIN-2-AMINE	A,B	3E67	0.73
BVF	4-METHYLPYRIDIN-2-AMINE	A	2EUT	0.73
IPL	INDOLE-3-PROPANOL PHOSPHATE	A,B	1BEU	0.71
IPL	INDOLE-3-PROPANOL PHOSPHATE	A,B	1QOP	0.71
IPL	INDOLE-3-PROPANOL PHOSPHATE	A,B	2TRS	0.71
IPL	INDOLE-3-PROPANOL PHOSPHATE	A	1WXJ	0.71
IPL	INDOLE-3-PROPANOL PHOSPHATE	A,B	1KFC	0.71
IND	INDOLE	A	1L4H	0.83
IND	INDOLE	A,B,G	1O7N	0.83
IND	INDOLE	A	185L	0.83
IND	INDOLE	A,B	1EG9	0.83
IND	INDOLE	A,B	1UUV	0.83
IND	INDOLE	A,C,E	2B24	0.83
IND	INDOLE	A,B,C,D,E,F	2P85	0.83
PBO	1-PYRIDIN-3-YLBUTAN-1-ONE	A	1PYJ	0.72
PF7	4-(quinolin-3-ylmethyl)piperidine-1-carboxylic acid	A,B	2VYA	0.74
4AP	4-AMINOPYRIDINE	A	1AEG	0.72
278	1-(1-methyl-1H-pyrrol-2-yl)methanamine	X	2RBV	0.85
QYT	(5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE-2,4-DIONE	A	2A5U	0.7
TSR	2-(1H-INDOL-3-YL)ACETAMIDE	D,H	2OJY	0.73
TSR	2-(1H-INDOL-3-YL)ACETAMIDE	A,D,H	2OIZ	0.73
DPT	4,7-DIMETHYL-[1,10]PHENANTHROLINE	A,B	1I53	0.76
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2Z2G	0.7
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2Z2H	0.7
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2HKC	0.7
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.84
3MP	3-METHYLPYRIDINE	A	1EUB	0.83
3MP	3-METHYLPYRIDINE	A	1BM6	0.83
MIL	MILRINONE	A,B	1TLM	0.71
EPJ	EPIBATIDINE	A,B,C,D,E	2BYQ	0.73
P83	1-(9-ethyl-9H-carbazol-3-yl)-N-methylmethanamine	A,B	2VUK	0.76
DEQ	DEQUALINIUM	A,B,D,E	1JT6	0.73
DEQ	DEQUALINIUM	A,B,D,E	3BR2	0.73
DEQ	DEQUALINIUM	A	1OYD	0.73
DEQ	DEQUALINIUM	A,B,D,E	3BT9	0.73
DEQ	DEQUALINIUM	A,B,D,E	3BTJ	0.73
DEQ	DEQUALINIUM	A,B,D,E	3BR1	0.73
GG5	4-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]PYRIDINE	A	3HVC	0.74
RIS	1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS-PHOSPHONIC ACID	A	1YV5	0.71
RIS	1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS-PHOSPHONIC ACID	A,B	1RQJ	0.71
RIS	1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS-PHOSPHONIC ACID	A	1YQ7	0.71
RIS	1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS-PHOSPHONIC ACID	A	1YHL	0.71
RIS	1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS-PHOSPHONIC ACID	A	2QIS	0.71
RIS	1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS-PHOSPHONIC ACID	A,B	2O1O	0.71
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D	2RFQ	0.74
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D,E,F	2GA4	0.74
1PS	3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE	A,B,C,D,E,F	1R4P	0.74
793	3-{[(1R)-1-phenylethyl]amino}-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione	A	3FPM	0.71
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.72
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2WHQ	0.71
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2WHP	0.71
HI6	4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM	A,B	2GYU	0.71
PIM	4-PHENYL-1H-IMIDAZOLE	A,B	2D0T	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A	1E9X	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHD	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A,B,C,D	2RFC	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A	1ODO	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A	3E5K	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHE	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A,B	1F4T	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A	1S1F	0.72
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHF	0.72
TOX	2-AMINO-3-(1-HYDROPEROXY-1H-INDOL-3-YL)PROPAN-1-OL	A,B	2DV2	0.71
TOX	2-AMINO-3-(1-HYDROPEROXY-1H-INDOL-3-YL)PROPAN-1-OL	A,B	2FXJ	0.71
047	1-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-1H-INDOL-3-YL]METHYL}METHANAMINE	A,B	2PJL	0.8
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.79
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.79
CLQ	N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE	A	1CET	0.72
D4G		A,B,C,D	2FDY	0.71
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2GYV	0.77
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2JF0	0.77
PHN	1,10-PHENANTHROLINE	A	1LIH	0.76
PHN	1,10-PHENANTHROLINE	A	2LIG	0.76
PHN	1,10-PHENANTHROLINE	A,B	2FU7	0.76
SB5	4-(FLUOROPHENYL)-1-CYCLOPROPYLMETHYL-5-(2-AMINO-4-PYRIMIDINYL)IMIDAZOLE	A	1BMK	0.7
364	3-BIPHENYL-3-YL-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM	A,B	2E94	0.73
PZZ	3-{3-[(DIMETHYLAMINO)METHYL]-1H-INDOL-7-YL}PROPAN-1-OL	A	2QHW	0.71
CRZ	4-(9H-CARBAZOL-9-YL)BUTANOIC ACID	A	1TOW	0.71
MIB	(3E)-4-(1-METHYL-1H-INDOL-3-YL)BUT-3-EN-2-ONE	A	1ZS5	0.84
654	4-(2-THIENYL)-1-(4-METHYLBENZYL)-1H-IMIDAZOLE	A,B	1I2Z	0.71
PYS	2-PYRIDINETHIOL	A,B	1CTE	0.72
PYS	2-PYRIDINETHIOL	A	2IPP	0.72
6IP	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE	A	2OHP	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	0.86
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.86
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.86
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B,D,H	2IUQ	0.81
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B	2FPB	0.81
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	D,H	2AGW	0.81
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A	2PQL	0.81
SB9	HYDROXY[3-(6-METHYLPYRIDIN-2-YL)PROPYL]FORMAMIDE	P	2AIE	0.7
LTN	L-TRYPTOPHANAMIDE	A	1MAU	0.73
LTN	L-TRYPTOPHANAMIDE	A,B	2QUI	0.73
1CM	(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE	A	2CI0	0.72
AGE	(2E)-N-hydroxy-3-[1-methyl-4-(phenylacetyl)-1H-pyrrol-2-yl]prop-2-enamide	A,B,C	3F07	0.74
FPH	3-(4-FLUOROPHENYL)-2-PYRIDIN-4-YL-1H-PYRROLO[3,2-B]PYRIDIN-1-OL	A	1OZ1	0.75
517	1-{2-OXO-3-[(1R)-1-(1H-PYRROL-2-YL)ETHYL]-2H-INDOL-5-YL}UREA	A	2PE1	0.73