Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00296577

Ligand	Ligand name	Chain	PDB	Tanimoto
QNC	2-CARBONYLQUINOLINE	A,B	1MTB	0.75
QNC	2-CARBONYLQUINOLINE	A,B	2FGV	0.75
QNC	2-CARBONYLQUINOLINE	I	1IVQ	0.75
QNC	2-CARBONYLQUINOLINE	A,B	2FGU	0.75
QNC	2-CARBONYLQUINOLINE	A	1JLD	0.75
QNC	2-CARBONYLQUINOLINE	A,B	1HXB	0.75
F11	N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLPENTANE-1,5-DIAMINE	A	2CMF	0.87
THA	TACRINE	A,B	2AOW	0.87
THA	TACRINE	A,B,C,D,E,F	1MX1	0.87
THA	TACRINE	A,B	2AOX	0.87
THA	TACRINE	A	1ACJ	0.87
UNN	(6,7-DIFLUORO-QUINAZOLIN-4-YL)-(1-METHYL-2,2-DIPHENYL-ETHYL)-AMINE	A,B,C	5STD	0.72
6IG	6-ETHYL-5-[1-(3-METHOXYPROPYL)-1,2,3,4-TETRAHYDROQUINOLIN-7-YL]-N~4~-(2-PHENYLETHYL)PYRIMIDINE-2,4-DIAMINE	A,B	2G22	0.7
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.72
BRA	9-[4-(n,n-dimethylamino)phenylamino]-3,6-bis(3-pyrrolidinopropionamido) acridine	A	3CE5	0.75
AS3	4-METHYL-6-PROPYLPYRIDIN-2-AMINE	A,B	3E6N	0.71
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N-OXIDE	A,B,C	1KQG	0.71
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N-OXIDE	A,B,C,D,E,F	2VR0	0.71
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N-OXIDE	A,B,C,M,N,O,P	1KF6	0.71
LIY	6-ETHYL-5-[(2S)-1-(3-METHOXYPROPYL)-2-PHENYL-1,2,3,4-TETRAHYDROQUINOLIN-7-YL]PYRIMIDINE-2,4-DIAMINE	A,B	2IKU	0.72
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.83
8AD	9-AMINO-(N-(2-DIMETHYLAMINO)BUTYL)ACRIDINE-4-CARBOXAMIDE	A,B	1FN2	0.71
8AD	9-AMINO-(N-(2-DIMETHYLAMINO)BUTYL)ACRIDINE-4-CARBOXAMIDE	A,B	1FN1	0.71
I40	9-(3-IODOBENZYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1QON	0.86
QNO	2-NONYL-4-HYDROXYQUINOLINE N-OXIDE	C,D,E	1NU1	0.71
QNO	2-NONYL-4-HYDROXYQUINOLINE N-OXIDE	A,B,C,D,G	2E75	0.71
047	1-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-1H-INDOL-3-YL]METHYL}METHANAMINE	A,B	2PJL	0.72
NCE	3,6-Bis[(3-morpholinopropionamido)] acridine	A,B	3EM2	0.75
OA4	5-methyl-6-phenylquinazoline-2,4-diamine	A	2W6P	0.73
214	6-[4-((2R)-2-(1H-1,2,3-BENZOTRIAZOL-1-YL)-3-{4-[DIFLUORO(PHOSPHONO)METHYL]PHENYL}-2-PHENYLPROPYL)PHENYL]-2-METHYLQUINOLIN-8-YLPHOSPHONIC ACID	A,B	1Q6S	0.72
2PT	1-[2-(ACRIDIN-9-YLAMINO)ETHYL]-1,3-DIMETHYLTHIOUREA-PLATINUM(II)-ETHANE-1,2-DIAMINE	B	1XRW	0.75
P83	1-(9-ethyl-9H-carbazol-3-yl)-N-methylmethanamine	A,B	2VUK	0.74
R1C	bis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)[chrysene-5,6-diiminato(2-)-kappa~2~N,N']rhodium(4+)	A	2O1I	0.72
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	0.72
R1C	bis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)[chrysene-5,6-diiminato(2-)-kappa~2~N,N']rhodium(4+)	A	3GSJ	0.72
PRL	PROFLAVIN	H,I	1BCU	0.86
PRL	PROFLAVIN	A,B,D,E	1QVT	0.86
PRL	PROFLAVIN	A,B	2KD4	0.86
PRL	PROFLAVIN	A	1QVU	0.86
A8N	N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)-1,8-DIAMINOOCTANE	A	1UT6	0.82
NCL	3,6-Bis{3-(3-[(3R)-methylpiperidino)]propionamido}acridine	A,B	3ET8	0.78
SN6	1-METHYL-4-[4-[4-(4-(1-METHYLQUINOLINIUM)AMINO)BENZAMIDO]ANILINO]PYRIDINIUM	A,B	144D	0.73
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	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	0.75
D23	6-(3-AMINOPHENYL)-N-(TERT-BUTYL)-2-(TRIFLUOROMETHYL)QUINAZOLIN-4-AMINE	A	2B53	0.72
SN7	4-[4-[2-AMINO-4-[4,6-(N-METHYLQUINOLINIUM)AMINO]BENZAMIDO]ANILINO]-N-METHYLPYRIDINIUM MESYLATE	A	328D	0.71
760	9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1DX4	0.88
DX2	6-phenylpteridine-2,4,7-triamine	A,B,C,D	3BME	0.71
9CA	9H-CARBAZOLE	A,B,C,D,E,F	2DE7	0.75
HUX	3-CHLORO-9-ETHYL-6,7,8,9,10,11-HEXAHYDRO-7,11-METHANOCYCLOOCTA[B]QUINOLIN-12-AMINE	A	1E66	0.79
9HP	9-(4-HYDROXYPHENYL)-2,7-PHENANTHROLINE	A	1PMU	0.7
AA7	N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLHEPTANE-1,7-DIAMINE	A	2CKM	0.87
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B,D,H	2IUQ	0.7
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A,B	2FPB	0.7
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	D,H	2AGW	0.7
TSS	2-(1H-INDOL-3-YL)ETHANAMINE	A	2PQL	0.7
7AD	9-AMINO-N-[3-(DIMETHYLAMINO)PROPYL]ACRIDINE-4-CARBOXAMIDE	A,B	1RQY	0.71
NCI	3,6-Bis{3-[(2R)-(2-ethylpiperidino)]propionamido}acridine	A,B,C,D	3EUI	0.77
NCI	3,6-Bis{3-[(2R)-(2-ethylpiperidino)]propionamido}acridine	A,B	3EQW	0.77
NCK	3,6-Bis[3-(4-methylpiperidino)propionamido]acridine	A,B	3ES0	0.78
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.72
TOT	1,1-(4,4,8,8-TETRAMETHYL-4,8-DIAZAUNDECAMETHYLENE)-BIS-4-3-METHYL-2,3-DIHYDRO-(BENZO-1,3-THIAZOLE)-2-METHYLIDENE)-QUINOLINIUM	A	108D	0.73
NCJ	3,6-Bis{3-[(2R)-2-methylpiperidino)]propionamido}acridine	A,B	3ERU	0.78
NCQ	3,6-Bis[3-(azepan-1-yl)propionamido]acridine	A,B	3EUM	0.74
2MI	2-METHYL-1H-INDOLE	A	2PIO	0.76
855	2-(6-methylpyridin-2-yl)-N-pyridin-4-ylquinazolin-4-amine	A	3HMM	0.7
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.77
DEQ	DEQUALINIUM	A,B,D,E	1JT6	0.86
DEQ	DEQUALINIUM	A,B,D,E	3BR2	0.86
DEQ	DEQUALINIUM	A	1OYD	0.86
DEQ	DEQUALINIUM	A,B,D,E	3BT9	0.86
DEQ	DEQUALINIUM	A,B,D,E	3BTJ	0.86
DEQ	DEQUALINIUM	A,B,D,E	3BR1	0.86
BMO	N-ACRIDIN-9-YL-N'-[3-(ACRIDIN-9-YLAMINO)PROPYL]PROPANE-1,3-DIAMINE	A	2GJB	0.88
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.76
BDC	BIS-(9-OCTYLAMINO(2-DIMETHYLAMINOETHYL)ACRIDINE-4-CARBOXAMIDE	A,B	1K2L	0.71
2AQ	QUINOLIN-2-AMINE	A	2OHL	0.81
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.72
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	0.72
23M	2-(3-METHYLPHENYL)-1H-INDOLE-5-CARBOXIMIDAMIDE	A	2G5N	0.74
D94	3-[cis-3-(4-methylpiperazin-1-yl)cyclobutyl]-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine	A	3D94	0.71
NSC	N,N'-BIS(4-AMINO-2-METHYLQUINOLIN-6-YL)UREA	A,B	1PWP	0.83
NC5	3-[(2R)-2-ethylpiperidin-1-yl]-N-[6-({3-[(2S)-2-ethylpiperidin-1-yl]propanoyl}amino)acridin-3-yl]propanamide	A,B,C,D	3EUI	0.77
MI2	2-(2-METHYLPHENYL)-1H-INDOLE-5-CARBOXIMIDAMIDE	A	2G8T	0.73
BRF		A	1UUO	0.71
PHN	1,10-PHENANTHROLINE	A	1LIH	0.81
PHN	1,10-PHENANTHROLINE	A	2LIG	0.81
PHN	1,10-PHENANTHROLINE	A,B	2FU7	0.81
LIH	6-([5-QUINOLYLAMINO]METHYL)-2,4-DIAMINO-5-METHYLPYRIDO[2,3-D]PYRIMIDINE	A	1KMS	0.7
LG1	3,11-DIFLUORO-6,8,13-TRIMETHYL-8H-QUINO[4,3,2-KL]ACRIDIN-13-IUM	A,B,D	1NZM	0.84
MGR	MALACHITE GREEN	A,B	3BQZ	0.72
MGR	MALACHITE GREEN	A	1Q8N	0.72
MGR	MALACHITE GREEN	A,B	3BR0	0.72
MGR	MALACHITE GREEN	A,D,E	3BTL	0.72
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.72
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.72
9AC	9-ACRIDINECARBONYL	A,B,G,J,K,L,M	1G3X	0.78
MM0	N,N'-(dibenzo[b,j][1,7]phenanthroline-2,10-diyldimethanediyl)dipropan-1-amine	B	2JWQ	0.87
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGY	0.7
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AH0	0.7
TSH	2-(1H-INDOL-3-YL)ETHANIMINE	D,H	2AGX	0.7
RKA	N,N'-(1H-PYRROLE-2,5-DIYLDI-4,1-PHENYLENE)DIBENZENECARBOXIMIDAMIDE	A	2GYX	0.76
22M	2-(2-METHYLPHENYL)-1H-INDOLE-6-CARBOXIMIDAMIDE	A	2G5V	0.74
CLQ	N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE	A	1CET	0.72
A4C	9,9'-(HEXANE-1,6-DIYLDIIMINO)BIS{N-[2-(DIMETHYLAMINO)ETHYL]ACRIDINE-4-CARBOXAMIDE}	A	2GWA	0.71
A4C	9,9'-(HEXANE-1,6-DIYLDIIMINO)BIS{N-[2-(DIMETHYLAMINO)ETHYL]ACRIDINE-4-CARBOXAMIDE}	A,B	2GB9	0.71
BRE	2-BIPHENYL-4-YL-6-FLUORO-3-METHYL-QUINOLINE-4-CARBOXYLIC ACID	A	1D3G	0.72
MQ0	(3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3-DIPHENYL-ALLYLIDENE)-AMINE	A,B,C	3STD	0.73
PF7	4-(quinolin-3-ylmethyl)piperidine-1-carboxylic acid	A,B	2VYA	0.78
PIU	1-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}-2,4,6-TRIMETHYLPYRIDINIUM	A	1ZE8	0.71
PRM	3,8-DIAMINO-5[3-(DIETHYLMETHYLAMMONIO)PROPYL]-6-PHENYLPHENANTHRIDINIUM	A,B	1N5R	0.82
DCU		A,B	1J07	0.82
A2E	(5S)-5-{[10-(1,2,3,4-TETRAHYDROACRIDIN-9-YLAMINO)DECYL]AMINO}-5,6,7,8-TETRAHYDROQUINOLIN-2(1H)-ONE	A,B	1ZGC	0.75
N8T	N-[8-(1,2,3,4-TETRAHYDROACRIDIN-9-YLTHIO)OCTYL]-1,2,3,4-TETRAHYDROACRIDIN-9-AMINE	A	2CEK	0.8
PY1	4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-YL)QUINOLINE	A	1PY5	0.71
PYN	3-PYRROLIDIN-1-YL-N-[6-(3-PYRROLIDIN-1-YL-PROPIONYLAMINO)-ACRIDIN-3-YL]-PROPIONAMIDE	A,B	1L1H	0.74
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	0.72
ISQ	ISOQUINOLINE	A	1GDK	0.75
DPT	4,7-DIMETHYL-[1,10]PHENANTHROLINE	A,B	1I53	0.8
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.7
TAQ	2,4,6-TRIAMINOQUINAZOLINE	A,B,C,D,E,F,G,H	1W0C	0.72
DAP	6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE	A	1D30	0.76
DAP	6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE	A	432D	0.76