Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00049344

Ligand	Ligand name	Chain	PDB	Tanimoto
6SC	3-bromo-5-phenyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine	A	2R3R	0.73
6IP	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE	A	2OHP	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
3MP	3-METHYLPYRIDINE	A	1EUB	0.75
3MP	3-METHYLPYRIDINE	A	1BM6	0.75
PY2	3-(MERCAPTOMETHYLENE)PYRIDINE	A,B	1IDA	0.72
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.72
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	0.79
5NI	5-NITROINDAZOLE	A,B	1M8I	0.7
5NI	5-NITROINDAZOLE	A,B	1M9Q	0.7
6NI	6-NITROINDAZOLE	A,B	1M8H	0.7
6NI	6-NITROINDAZOLE	A,B	1M9M	0.7
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.72
IND	INDOLE	A	1L4H	0.75
IND	INDOLE	A,B,G	1O7N	0.75
IND	INDOLE	A	185L	0.75
IND	INDOLE	A,B	1EG9	0.75
IND	INDOLE	A,B	1UUV	0.75
IND	INDOLE	A,C,E	2B24	0.75
IND	INDOLE	A,B,C,D,E,F	2P85	0.75
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	0.79
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.79
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.79
L15	2-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINE	A	2UW4	0.78
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGY	0.76
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AH0	0.76
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGX	0.76
LL1	3-pyridin-4-yl-1H-indazole	A	3DNE	0.89
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.77
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.77
3AP	3-AMINOPYRIDINE	A	1AEF	0.74
RW1	4-phenylpyrimidine	A,B,C	3B9S	0.72
HYZ	N-[1-(3-fluorobenzyl)-1H-indazol-5-yl]-5-[(piperidin-1-ylamino)methyl]pyrimidine-4,6-diamine	A	2RGP	0.72
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.79
580	3-(4-FLUOROPHENYL)-2-(6-METHYLPYRIDIN-2-YL)-5,6-DIHYDRO-4H-PYRROLO[1,2-B]PYRAZOLE	A	1RW8	0.77
PY1	4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-YL)QUINOLINE	A	1PY5	0.86
FRZ	5-(2-PHENYLPYRAZOLO[1,5-A]PYRIDIN-3-YL)-1H-PYRAZOLO[3,4-C]PYRIDAZIN-3-AMINE	A	1TVO	0.73
KS1	1-cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine	A,B	3EN4	0.72
SCJ	3-bromo-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine	A	2R3J	0.73
A8N	N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)-1,8-DIAMINOOCTANE	A	1UT6	0.72
LZ5	N-phenyl-1H-pyrazole-3-carboxamide	A	2VTL	0.71
KS5	1-(1-methylethyl)-3-quinolin-6-yl-1H-pyrazolo[3,4-d]pyrimidin-4-amine	B	3EN6	0.7
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.71
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.74
19A	N,N-DIMETHYL-4-(4-PHENYL-1H-PYRAZOL-3-YL)-1H-PYRROLE-2-CARBOXAMIDE	A	2OJG	0.73
278	1-(1-methyl-1H-pyrrol-2-yl)methanamine	X	2RBV	0.73
CT6	(5Z)-5-(3-BROMOCYCLOHEXA-2,5-DIEN-1-YLIDENE)-N-(PYRIDIN-4-YLMETHYL)-1,5-DIHYDROPYRAZOLO[1,5-A]PYRIMIDIN-7-AMINE	A	2C68	0.73
ISQ	ISOQUINOLINE	A	1GDK	0.72
D26	PHENYL-5-(1H-PYRAZOL-3-YL)-1,3-THIAZOLE	A,B,C,D	2VCX	0.8
4AP	4-AMINOPYRIDINE	A	1AEG	0.77
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.73
460	2-[5-(6-METHYLPYRIDIN-2-YL)-2,3-DIHYDRO-1H-PYRAZOL-4-YL]-1,5-NAPHTHYRIDINE	A	1VJY	0.74
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.77
R20	4-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLE	A	2ADU	0.73
FPH	3-(4-FLUOROPHENYL)-2-PYRIDIN-4-YL-1H-PYRROLO[3,2-B]PYRIDIN-1-OL	A	1OZ1	0.7
EPJ	EPIBATIDINE	A,B,C,D,E	2BYQ	0.73
SCQ	3-bromo-5-phenyl-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]pyridin-7-amine	A	2R3K	0.71
GG5	4-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]PYRIDINE	A	3HVC	0.93
SCZ	3-cyclopropyl-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine	A	2R3N	0.73
1CM	(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE	A	2CI0	0.7
VC3	3-(4-nitrophenyl)-1H-pyrazole	A,B,C,D	2VCZ	0.74
SCF	5-(2-fluorophenyl)-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine	A	2R3I	0.73
760	9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1DX4	0.7
LG4	5-METHYLPYRIDIN-2-AMINE	A	2EUP	0.71
NTN	ISONICOTINAMIDINE	A	7ADH	0.74
5BP	N-cyclopropyl-4-pyrazolo[1,5-b]pyridazin-3-ylpyrimidin-2-amine	A,C	3EJ1	0.75
L02	4-[3-(4-CHLOROPHENYL)-1H-PYRAZOL-5-YL]PIPERIDINE	B,I	1WAY	0.74
LZ1	1H-indazole	A,B	3E6I	0.76
LZ1	1H-indazole	A	2VTA	0.76
FYX	4-(5-PYRIDIN-4-YL-1H-1,2,4-TRIAZOL-3-YL)PYRIDINE-2-CARBONITRILE	A,B	1V97	0.76
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B,D,H	2IUQ	0.76
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B	2FPB	0.76
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	D,H	2AGW	0.76
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A	2PQL	0.76
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2GYV	0.7
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2JF0	0.7
LIG	3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-.C.]PYRAZOLE	P	1JVP	0.88
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.73
422	3-(5-{[4-(AMINOMETHYL)PIPERIDIN-1-YL]METHYL}-1H-INDOL-2-YL)-1H-INDAZOLE-6-CARBONITRILE	A	2HXL	0.71
CT8	(5Z)-5-(3-BROMOCYCLOHEXA-2,5-DIEN-1-YLIDENE)-N-(PYRIDIN-4-YLMETHYL)-1,5-DIHYDRO[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-AMINE	A	2C69	0.72
GVG	3-METHYL-4-PHENYL-1H-PYRAZOLE	A	2UW3	0.79
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNF	0.7
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2H9V	0.7
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A,B	2ETR	0.7
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	2GNJ	0.7
Y27	(R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXANECARBOXAMIDE	A	1Q8T	0.7