Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03894049

Ligand	Ligand name	Chain	PDB	Tanimoto
3MP	3-METHYLPYRIDINE	A	1EUB	0.73
3MP	3-METHYLPYRIDINE	A	1BM6	0.73
PIQ	2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE	A,B	2QXM	0.72
PIQ	2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE	A	1HZ0	0.72
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.74
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.74
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.76
FPH	3-(4-FLUOROPHENYL)-2-PYRIDIN-4-YL-1H-PYRROLO[3,2-B]PYRIDIN-1-OL	A	1OZ1	0.79
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B,D,H	2IUQ	0.74
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B	2FPB	0.74
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	D,H	2AGW	0.74
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A	2PQL	0.74
IP6	N~3~-[3-(1H-INDOL-6-YL)BENZYL]PYRIDINE-2,3-DIAMINE	A	2OHT	0.73
PF7	4-(quinolin-3-ylmethyl)piperidine-1-carboxylic acid	A,B	2VYA	0.82
55F	N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide	A,B,C,D,E	3FAA	0.73
MIB	(3E)-4-(1-METHYL-1H-INDOL-3-YL)BUT-3-EN-2-ONE	A	1ZS5	0.71
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.77
PY2	3-(MERCAPTOMETHYLENE)PYRIDINE	A,B	1IDA	0.7
IQP	1-(5-ISOQUINOLINESULFONYL)-2-METHYLPIPERAZINE	E	1YDR	0.73
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2Z2G	0.76
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2Z2H	0.76
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2HKC	0.76
NTN	ISONICOTINAMIDINE	A	7ADH	0.71
MM0	N,N'-(dibenzo[b,j][1,7]phenanthroline-2,10-diyldimethanediyl)dipropan-1-amine	B	2JWQ	0.74
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
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.82
D94	3-[cis-3-(4-methylpiperazin-1-yl)cyclobutyl]-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine	A	3D94	0.7
IQU	N-(2-AMINOETHYL)ISOQUINOLINE-5-SULFONAMIDE	A,B,C,D	2CKE	0.72
A8N	N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)-1,8-DIAMINOOCTANE	A	1UT6	0.76
ISQ	ISOQUINOLINE	A	1GDK	0.81
SB6	4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE	A	1BL6	0.73
DPT	4,7-DIMETHYL-[1,10]PHENANTHROLINE	A,B	1I53	0.96
BMO	N-ACRIDIN-9-YL-N'-[3-(ACRIDIN-9-YLAMINO)PROPYL]PROPANE-1,3-DIAMINE	A	2GJB	0.75
8IP	N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE-2,3-DIAMINE	A	2OHR	0.76
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.83
LIH	6-([5-QUINOLYLAMINO]METHYL)-2,4-DIAMINO-5-METHYLPYRIDO[2,3-D]PYRIMIDINE	A	1KMS	0.71
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.76
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.84
LL1	3-pyridin-4-yl-1H-indazole	A	3DNE	0.73
PMD	[N-(2,4-DIAMINOPTERIDIN-6-YL)-METHYL]-DIBENZ[B,F]AZEPINE	A	1KLK	0.73
DCU		A,B	1J07	0.73
9HP	9-(4-HYDROXYPHENYL)-2,7-PHENANTHROLINE	A	1PMU	0.72
CNQ	3-(4-CHLOROPHENYL)QUINOXALINE-5-CARBOXAMIDE	A,B,C,D	1WOK	0.73
OBI	1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME	A,B	2GYW	0.7
PHN	1,10-PHENANTHROLINE	A	1LIH	0.97
PHN	1,10-PHENANTHROLINE	A	2LIG	0.97
PHN	1,10-PHENANTHROLINE	A,B	2FU7	0.97
RW1	4-phenylpyrimidine	A,B,C	3B9S	0.72
2AQ	QUINOLIN-2-AMINE	A	2OHL	0.73
PRM	3,8-DIAMINO-5[3-(DIETHYLMETHYLAMMONIO)PROPYL]-6-PHENYLPHENANTHRIDINIUM	A,B	1N5R	0.74
PYA	3-(1,10-PHENANTHROL-2-YL)-L-ALANINE	A	1HCW	0.79
PY1	4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-YL)QUINOLINE	A	1PY5	0.78
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.74
047	1-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-1H-INDOL-3-YL]METHYL}METHANAMINE	A,B	2PJL	0.71
R1C	bis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)[chrysene-5,6-diiminato(2-)-kappa~2~N,N']rhodium(4+)	A	2O1I	0.71
R1C	bis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)[chrysene-5,6-diiminato(2-)-kappa~2~N,N']rhodium(4+)	A,B	3GSK	0.71
R1C	bis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)[chrysene-5,6-diiminato(2-)-kappa~2~N,N']rhodium(4+)	A	3GSJ	0.71
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.76
QYT	(5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE-2,4-DIONE	A	2A5U	0.77
TZ4	3,8-DIAMINO-6-PHENYL-5-[6-[1-[2-[(1,2,3,4-TETRAHYDRO-9-ACRIDINYL)AMINO]ETHYL]-1H-1,2,3-TRIAZOL-4-YL]HEXYL]-PHENANTHRIDINIUM	A,B	1Q84	0.75
L1B	7-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-1-(3-METHOXYPROPYL)QUINOLINIUM	A,B	2G21	0.73
THA	TACRINE	A,B	2AOW	0.78
THA	TACRINE	A,B,C,D,E,F	1MX1	0.78
THA	TACRINE	A,B	2AOX	0.78
THA	TACRINE	A	1ACJ	0.78
I40	9-(3-IODOBENZYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1QON	0.79
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	0.74
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.74
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.74
QUI	2-CARBOXYQUINOXALINE	A	1PFE	0.7
QUI	2-CARBOXYQUINOXALINE	A,B	2DA8	0.7
QUI	2-CARBOXYQUINOXALINE	A,C,E,G	2ADW	0.7
QUI	2-CARBOXYQUINOXALINE	A	1VS2	0.7
QUI	2-CARBOXYQUINOXALINE	A	1XVN	0.7
QUI	2-CARBOXYQUINOXALINE	A,B	185D	0.7
QUI	2-CARBOXYQUINOXALINE	A	1XVK	0.7
QUI	2-CARBOXYQUINOXALINE	A,C	1XVR	0.7
QUI	2-CARBOXYQUINOXALINE	A,B	3GO3	0.7
3AP	3-AMINOPYRIDINE	A	1AEF	0.71
CLQ	N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE	A	1CET	0.75
NPH	CYSTEINE-METHYLENE-CARBAMOYL-1,10-PHENANTHROLINE	A	1A18	0.74
IMQ	(2R,3R,4S)-2-(hydroxymethyl)-1-(quinolin-8-ylmethyl)pyrrolidine-3,4-diol	A,B	3EPX	0.72
DEQ	DEQUALINIUM	A,B,D,E	1JT6	0.77
DEQ	DEQUALINIUM	A,B,D,E	3BR2	0.77
DEQ	DEQUALINIUM	A	1OYD	0.77
DEQ	DEQUALINIUM	A,B,D,E	3BT9	0.77
DEQ	DEQUALINIUM	A,B,D,E	3BTJ	0.77
DEQ	DEQUALINIUM	A,B,D,E	3BR1	0.77
SB4	4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE	A	1BL7	0.71
SB4	4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE	A	3ERK	0.71
3B3	(2S)-1-AMINO-3-[(5-NITROQUINOLIN-8-YL)AMINO]PROPAN-2-OL	A	2CGV	0.75
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGY	0.74
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AH0	0.74
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGX	0.74
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.75
AA7	N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLHEPTANE-1,7-DIAMINE	A	2CKM	0.75
6IP	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE	A	2OHP	0.73
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin-6-yl]benzoic acid	A,B	2QYN	0.7
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin-6-yl]benzoic acid	A,B	2QYK	0.7
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin-6-yl]benzoic acid	A	2QYL	0.7
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.72
PRL	PROFLAVIN	H,I	1BCU	0.76
PRL	PROFLAVIN	A,B,D,E	1QVT	0.76
PRL	PROFLAVIN	A,B	2KD4	0.76
PRL	PROFLAVIN	A	1QVU	0.76
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
F11	N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLPENTANE-1,5-DIAMINE	A	2CMF	0.75
NSC	N,N'-BIS(4-AMINO-2-METHYLQUINOLIN-6-YL)UREA	A,B	1PWP	0.71
LG1	3,11-DIFLUORO-6,8,13-TRIMETHYL-8H-QUINO[4,3,2-KL]ACRIDIN-13-IUM	A,B,D	1NZM	0.73
460	2-[5-(6-METHYLPYRIDIN-2-YL)-2,3-DIHYDRO-1H-PYRAZOL-4-YL]-1,5-NAPHTHYRIDINE	A	1VJY	0.77
855	2-(6-methylpyridin-2-yl)-N-pyridin-4-ylquinazolin-4-amine	A	3HMM	0.74
IQS	N-[2-(METHYLAMINO)ETHYL]-5-ISOQUINOLINESULFONAMIDE	E	1YDS	0.71
TZ5	3,8-DIAMINO-6-PHENYL-5-[6-[1-[2-[(1,2,3,4-TETRAHYDRO-9-ACRIDINYL)AMINO]ETHYL]-1H-1,2,3-TRIAZOL-5-YL]HEXYL]-PHENANTHRIDINIUM	A,B	1Q83	0.74
2PT	1-[2-(ACRIDIN-9-YLAMINO)ETHYL]-1,3-DIMETHYLTHIOUREA-PLATINUM(II)-ETHANE-1,2-DIAMINE	B	1XRW	0.71
760	9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1DX4	0.77