Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02845111

Ligand	Ligand name	Chain	PDB	Tanimoto
580	3-(4-FLUOROPHENYL)-2-(6-METHYLPYRIDIN-2-YL)-5,6-DIHYDRO-4H-PYRROLO[1,2-B]PYRAZOLE	A	1RW8	0.73
MM0	N,N'-(dibenzo[b,j][1,7]phenanthroline-2,10-diyldimethanediyl)dipropan-1-amine	B	2JWQ	0.73
PHN	1,10-PHENANTHROLINE	A	1LIH	0.75
PHN	1,10-PHENANTHROLINE	A	2LIG	0.75
PHN	1,10-PHENANTHROLINE	A,B	2FU7	0.75
QNC	2-CARBONYLQUINOLINE	A,B	1MTB	0.73
QNC	2-CARBONYLQUINOLINE	A,B	2FGV	0.73
QNC	2-CARBONYLQUINOLINE	I	1IVQ	0.73
QNC	2-CARBONYLQUINOLINE	A,B	2FGU	0.73
QNC	2-CARBONYLQUINOLINE	A	1JLD	0.73
QNC	2-CARBONYLQUINOLINE	A,B	1HXB	0.73
MIB	(3E)-4-(1-METHYL-1H-INDOL-3-YL)BUT-3-EN-2-ONE	A	1ZS5	0.71
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	0.82
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.82
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.82
PRM	3,8-DIAMINO-5[3-(DIETHYLMETHYLAMMONIO)PROPYL]-6-PHENYLPHENANTHRIDINIUM	A,B	1N5R	0.72
26D	PYRIDINE-2,6-DIAMINE	A	2ANZ	0.73
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.76
SB9	HYDROXY[3-(6-METHYLPYRIDIN-2-YL)PROPYL]FORMAMIDE	P	2AIE	0.8
DCU		A,B	1J07	0.72
BMO	N-ACRIDIN-9-YL-N'-[3-(ACRIDIN-9-YLAMINO)PROPYL]PROPANE-1,3-DIAMINE	A	2GJB	0.72
RW1	4-phenylpyrimidine	A,B,C	3B9S	0.73
A8N	N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)-1,8-DIAMINOOCTANE	A	1UT6	0.76
GG5	4-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]PYRIDINE	A	3HVC	0.71
DAP	6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE	A	1D30	0.72
DAP	6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE	A	432D	0.72
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.77
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.77
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGY	0.71
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AH0	0.71
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGX	0.71
9CA	9H-CARBAZOLE	A,B,C,D,E,F	2DE7	0.75
PF7	4-(quinolin-3-ylmethyl)piperidine-1-carboxylic acid	A,B	2VYA	0.71
NSC	N,N'-BIS(4-AMINO-2-METHYLQUINOLIN-6-YL)UREA	A,B	1PWP	0.72
DPT	4,7-DIMETHYL-[1,10]PHENANTHROLINE	A,B	1I53	0.75
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.79
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.81
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.75
RKA	N,N'-(1H-PYRROLE-2,5-DIYLDI-4,1-PHENYLENE)DIBENZENECARBOXIMIDAMIDE	A	2GYX	0.72
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.74
LG4	5-METHYLPYRIDIN-2-AMINE	A	2EUP	0.72
I40	9-(3-IODOBENZYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1QON	0.75
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.71
CP7	6-ETHYL-5-PHENYLPYRIMIDINE-2,4-DIAMINE	A	2BLC	0.75
CP7	6-ETHYL-5-PHENYLPYRIMIDINE-2,4-DIAMINE	A	2BLB	0.75
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.71
HUX	3-CHLORO-9-ETHYL-6,7,8,9,10,11-HEXAHYDRO-7,11-METHANOCYCLOOCTA[B]QUINOLIN-12-AMINE	A	1E66	0.73
22M	2-(2-METHYLPHENYL)-1H-INDOLE-6-CARBOXIMIDAMIDE	A	2G5V	0.72
23M	2-(3-METHYLPHENYL)-1H-INDOLE-5-CARBOXIMIDAMIDE	A	2G5N	0.73
AS3	4-METHYL-6-PROPYLPYRIDIN-2-AMINE	A,B	3E6N	0.86
2AQ	QUINOLIN-2-AMINE	A	2OHL	0.79
MGR	MALACHITE GREEN	A,B	3BQZ	0.73
MGR	MALACHITE GREEN	A	1Q8N	0.73
MGR	MALACHITE GREEN	A,B	3BR0	0.73
MGR	MALACHITE GREEN	A,D,E	3BTL	0.73
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.73
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.73
ISQ	ISOQUINOLINE	A	1GDK	0.78
AA7	N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLHEPTANE-1,7-DIAMINE	A	2CKM	0.73
PY2	3-(MERCAPTOMETHYLENE)PYRIDINE	A,B	1IDA	0.76
MI2	2-(2-METHYLPHENYL)-1H-INDOLE-5-CARBOXIMIDAMIDE	A	2G8T	0.72
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.72
9AC	9-ACRIDINECARBONYL	A,B,G,J,K,L,M	1G3X	0.74
JI2	N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine	A,B	3B3N	0.75
JI2	N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine	A,B	3DQR	0.75
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.71
2MI	2-METHYL-1H-INDOLE	A	2PIO	0.79
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2GYV	0.73
HBP	1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME	A,B	2JF0	0.73
1CM	(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE	A	2CI0	0.7
P83	1-(9-ethyl-9H-carbazol-3-yl)-N-methylmethanamine	A,B	2VUK	0.71
F11	N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLPENTANE-1,5-DIAMINE	A	2CMF	0.73
3MP	3-METHYLPYRIDINE	A	1EUB	0.81
3MP	3-METHYLPYRIDINE	A	1BM6	0.81
PRL	PROFLAVIN	H,I	1BCU	0.81
PRL	PROFLAVIN	A,B,D,E	1QVT	0.81
PRL	PROFLAVIN	A,B	2KD4	0.81
PRL	PROFLAVIN	A	1QVU	0.81
OBI	1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME	A,B	2GYW	0.71
NTN	ISONICOTINAMIDINE	A	7ADH	0.75
PIU	1-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}-2,4,6-TRIMETHYLPYRIDINIUM	A	1ZE8	0.76
THA	TACRINE	A,B	2AOW	0.84
THA	TACRINE	A,B,C,D,E,F	1MX1	0.84
THA	TACRINE	A,B	2AOX	0.84
THA	TACRINE	A	1ACJ	0.84
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B,D,H	2IUQ	0.71
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B	2FPB	0.71
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	D,H	2AGW	0.71
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A	2PQL	0.71
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.73
DEQ	DEQUALINIUM	A,B,D,E	1JT6	0.74
DEQ	DEQUALINIUM	A,B,D,E	3BR2	0.74
DEQ	DEQUALINIUM	A	1OYD	0.74
DEQ	DEQUALINIUM	A,B,D,E	3BT9	0.74
DEQ	DEQUALINIUM	A,B,D,E	3BTJ	0.74
DEQ	DEQUALINIUM	A,B,D,E	3BR1	0.74
EPJ	EPIBATIDINE	A,B,C,D,E	2BYQ	0.7
BVF	4-METHYLPYRIDIN-2-AMINE	A,B	3E67	0.72
BVF	4-METHYLPYRIDIN-2-AMINE	A	2EUT	0.72
PBO	1-PYRIDIN-3-YLBUTAN-1-ONE	A	1PYJ	0.73
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.77
760	9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1DX4	0.77
IND	INDOLE	A	1L4H	0.71
IND	INDOLE	A,B,G	1O7N	0.71
IND	INDOLE	A	185L	0.71
IND	INDOLE	A,B	1EG9	0.71
IND	INDOLE	A,B	1UUV	0.71
IND	INDOLE	A,C,E	2B24	0.71
IND	INDOLE	A,B,C,D,E,F	2P85	0.71