Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02101768

Ligand	Ligand name	Chain	PDB	Tanimoto
MM0	N,N'-(dibenzo[b,j][1,7]phenanthroline-2,10-diyldimethanediyl)dipropan-1-amine	B	2JWQ	0.73
55F	N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide	A,B,C,D,E	3FAA	0.75
ISQ	ISOQUINOLINE	A	1GDK	0.79
246	1-benzyl-3-(2-chloropyridin-4-yl)urea	A	2QPM	0.75
RBS	N-(4-PHENYLAMINO-QUINAZOLIN-6-YL)-ACRYLAMIDE	A,B	2HWO	0.73
UNN	(6,7-DIFLUORO-QUINAZOLIN-4-YL)-(1-METHYL-2,2-DIPHENYL-ETHYL)-AMINE	A,B,C	5STD	0.72
AYM	3-(6-AMINOPYRIDIN-3-YL)-N-METHYL-N-[(1-METHYL-1H-INDOL-2-YL)METHYL]ACRYLAMIDE	A,B	1LXC	0.73
IQP	1-(5-ISOQUINOLINESULFONYL)-2-METHYLPIPERAZINE	E	1YDR	0.74
DEQ	DEQUALINIUM	A,B,D,E	1JT6	0.76
DEQ	DEQUALINIUM	A,B,D,E	3BR2	0.76
DEQ	DEQUALINIUM	A	1OYD	0.76
DEQ	DEQUALINIUM	A,B,D,E	3BT9	0.76
DEQ	DEQUALINIUM	A,B,D,E	3BTJ	0.76
DEQ	DEQUALINIUM	A,B,D,E	3BR1	0.76
8IP	N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE-2,3-DIAMINE	A	2OHR	0.8
2MI	2-METHYL-1H-INDOLE	A	2PIO	0.7
AP6	2,4-DIAMINO-6-PHENYL-5,6,7,8,-TETRAHYDROPTERIDINE	A,B	1DMK	0.71
NSC	N,N'-BIS(4-AMINO-2-METHYLQUINOLIN-6-YL)UREA	A,B	1PWP	0.75
SB6	4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE	A	1BL6	0.74
AUP	2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE	A	2AAQ	0.72
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.8
255	N-(tert-butyl)-4-[5-(pyridin-2-ylamino)quinolin-3-yl]benzenesulfonamide	A,B	2R9S	0.72
HM2	5-CHLORO-6-METHYL-N-(2-PHENYLETHYL)-2-PYRIDIN-2-YLPYRIMIDIN-4-AMINE	A	2G6P	0.72
DPT	4,7-DIMETHYL-[1,10]PHENANTHROLINE	A,B	1I53	0.86
LG4	5-METHYLPYRIDIN-2-AMINE	A	2EUP	0.74
PY1	4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-YL)QUINOLINE	A	1PY5	0.75
275	5-amino-1,2-dimethylpyridinium	X	2RBW	0.77
855	2-(6-methylpyridin-2-yl)-N-pyridin-4-ylquinazolin-4-amine	A	3HMM	0.79
H52	(S)-2-METHYL-1-[(4-METHYL-5-ISOQUINOLINE)SULFONYL]-HOMOPIPERAZINE	A	1Q8U	0.71
H52	(S)-2-METHYL-1-[(4-METHYL-5-ISOQUINOLINE)SULFONYL]-HOMOPIPERAZINE	A,B	3D9V	0.71
H52	(S)-2-METHYL-1-[(4-METHYL-5-ISOQUINOLINE)SULFONYL]-HOMOPIPERAZINE	A	2GNH	0.71
H52	(S)-2-METHYL-1-[(4-METHYL-5-ISOQUINOLINE)SULFONYL]-HOMOPIPERAZINE	A	2GNL	0.71
IMB	[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID	A,B	1T1R	0.75
C4E	N-phenyl-1H-pyrrolo[2,3-b]pyridin-3-amine	A,B,C,D	3C4E	0.73
APY	2-AMINOMETHYL-PYRIDINE	A,B,I	1HIV	0.75
APY	2-AMINOMETHYL-PYRIDINE	I	1IVP	0.75
MOJ	(5E,7S)-2-amino-7-(4-fluoro-2-pyridin-3-ylphenyl)-4-methyl-7,8-dihydroquinazolin-5(6H)-one oxime	A	3FT8	0.71
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
NPM	N-[(1E)-PYRIDIN-2-YLMETHYLENE]-N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE	A,B	2ET0	0.76
IQU	N-(2-AMINOETHYL)ISOQUINOLINE-5-SULFONAMIDE	A,B,C,D	2CKE	0.75
2PT	1-[2-(ACRIDIN-9-YLAMINO)ETHYL]-1,3-DIMETHYLTHIOUREA-PLATINUM(II)-ETHANE-1,2-DIAMINE	B	1XRW	0.77
DCU		A,B	1J07	0.73
LIH	6-([5-QUINOLYLAMINO]METHYL)-2,4-DIAMINO-5-METHYLPYRIDO[2,3-D]PYRIMIDINE	A	1KMS	0.76
047	1-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-1H-INDOL-3-YL]METHYL}METHANAMINE	A,B	2PJL	0.73
LL1	3-pyridin-4-yl-1H-indazole	A	3DNE	0.75
CNQ	3-(4-CHLOROPHENYL)QUINOXALINE-5-CARBOXAMIDE	A,B,C,D	1WOK	0.73
8AP	N~3~-BENZYLPYRIDINE-2,3-DIAMINE	A	2OHM	0.85
3AP	3-AMINOPYRIDINE	A	1AEF	0.74
UI2	8-(PYRIMIDIN-2-YLAMINO)NAPHTHALENE-2-CARBOXIMIDAMIDE	A	1SQO	0.74
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.81
DA1	PYRIDINE-2,5-DIAMINE	A	2AQD	0.75
SB4	4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE	A	1BL7	0.73
SB4	4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE	A	3ERK	0.73
PRM	3,8-DIAMINO-5[3-(DIETHYLMETHYLAMMONIO)PROPYL]-6-PHENYLPHENANTHRIDINIUM	A,B	1N5R	0.74
T27	4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile	A,B	2ZD1	0.71
T27	4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile	A	2ZE2	0.71
T27	4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile	A,B	3BGR	0.71
PF7	4-(quinolin-3-ylmethyl)piperidine-1-carboxylic acid	A,B	2VYA	0.76
PMD	[N-(2,4-DIAMINOPTERIDIN-6-YL)-METHYL]-DIBENZ[B,F]AZEPINE	A	1KLK	0.74
OA4	5-methyl-6-phenylquinazoline-2,4-diamine	A	2W6P	0.7
245	1-(2-chloropyridin-4-yl)-3-phenylurea	A	2QKN	0.71
EPJ	EPIBATIDINE	A,B,C,D,E	2BYQ	0.71
286	2-ethenyl-1-methylpyridinium	X	2RC2	0.71
I40	9-(3-IODOBENZYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1QON	0.75
IP6	N~3~-[3-(1H-INDOL-6-YL)BENZYL]PYRIDINE-2,3-DIAMINE	A	2OHT	0.77
PRL	PROFLAVIN	H,I	1BCU	0.77
PRL	PROFLAVIN	A,B,D,E	1QVT	0.77
PRL	PROFLAVIN	A,B	2KD4	0.77
PRL	PROFLAVIN	A	1QVU	0.77
BMO	N-ACRIDIN-9-YL-N'-[3-(ACRIDIN-9-YLAMINO)PROPYL]PROPANE-1,3-DIAMINE	A	2GJB	0.74
C8C	2-amino-6-[2-(1H-indol-6-yl)ethyl]pyrimidin-4(3H)-one	A	2VA5	0.72
PIQ	2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE	A,B	2QXM	0.75
PIQ	2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE	A	1HZ0	0.75
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2Z2G	0.8
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2Z2H	0.8
GIQ	3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE	A	2HKC	0.8
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	0.73
A8N	N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)-1,8-DIAMINOOCTANE	A	1UT6	0.77
L12	3-(2-PYRIDIN-4-YLETHYL)-1H-INDOLE	A	1W84	0.78
5MS	N-{2-methyl-5-[(6-phenylpyrimidin-4-yl)amino]phenyl}methanesulfonamide	A	3EXO	0.7
SB5	4-(FLUOROPHENYL)-1-CYCLOPROPYLMETHYL-5-(2-AMINO-4-PYRIMIDINYL)IMIDAZOLE	A	1BMK	0.73
AA7	N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLHEPTANE-1,7-DIAMINE	A	2CKM	0.74
FPH	3-(4-FLUOROPHENYL)-2-PYRIDIN-4-YL-1H-PYRROLO[3,2-B]PYRIDIN-1-OL	A	1OZ1	0.72
C48	N1-(1-DIMETHYLCARBAMOYL-2-PHENYL-ETHYL)-2-OXO-N4-(2-PYRIDIN-2-YL-ETHYL)-SUCCINAMIDE	A	1CVZ	0.7
PYA	3-(1,10-PHENANTHROL-2-YL)-L-ALANINE	A	1HCW	0.75
DMD	5,6-DIMETHYLBENZIMIDAZOLE	A	1D0S	0.72
6IP	6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE	A	2OHP	0.78
C4C	N-(4-chlorobenzyl)-N',N'-dimethyl-N-pyridin-2-ylethane-1,2-diamine	A	2RA7	0.7
IMQ	(2R,3R,4S)-2-(hydroxymethyl)-1-(quinolin-8-ylmethyl)pyrrolidine-3,4-diol	A,B	3EPX	0.7
BVF	4-METHYLPYRIDIN-2-AMINE	A,B	3E67	0.73
BVF	4-METHYLPYRIDIN-2-AMINE	A	2EUT	0.73
SCE	3-methyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine	A	2R3H	0.71
THA	TACRINE	A,B	2AOW	0.77
THA	TACRINE	A,B,C,D,E,F	1MX1	0.77
THA	TACRINE	A,B	2AOX	0.77
THA	TACRINE	A	1ACJ	0.77
QYT	(5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE-2,4-DIONE	A	2A5U	0.78
AS3	4-METHYL-6-PROPYLPYRIDIN-2-AMINE	A,B	3E6N	0.72
QMS	N-(QUINOLIN-8-YL)METHANESULFONAMIDE	A	2BB7	0.88
LTN	L-TRYPTOPHANAMIDE	A	1MAU	0.7
LTN	L-TRYPTOPHANAMIDE	A,B	2QUI	0.7
5IQ	ISOQUINOLIN-5-AMINE	A,B	2F2T	0.86
2AQ	QUINOLIN-2-AMINE	A	2OHL	0.81
460	2-[5-(6-METHYLPYRIDIN-2-YL)-2,3-DIHYDRO-1H-PYRAZOL-4-YL]-1,5-NAPHTHYRIDINE	A	1VJY	0.74
M77	5-(1,4-DIAZEPAN-1-SULFONYL)ISOQUINOLINE	A,B	2ESM	0.74
M77	5-(1,4-DIAZEPAN-1-SULFONYL)ISOQUINOLINE	A,B	2F2U	0.74
M77	5-(1,4-DIAZEPAN-1-SULFONYL)ISOQUINOLINE	A	2GNI	0.74
M77	5-(1,4-DIAZEPAN-1-SULFONYL)ISOQUINOLINE	A	1Q8W	0.74
L1B	7-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-1-(3-METHOXYPROPYL)QUINOLINIUM	A,B	2G21	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	0.73
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.73
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.73
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
CPZ	4-(4-CHLOROPHENYL)IMIDAZOLE	A	1SUO	0.7
ABI	5-AMIDINO-BENZIMIDAZOLE	A	1C2K	0.73
TPB	4-[4-(2,4,6-TRIMETHYL-PHENYLAMINO)-PYRIMIDIN-2-YLAMINO]-BENZONITRILE	A	1S6Q	0.71
GG5	4-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]PYRIDINE	A	3HVC	0.7
PIM	4-PHENYL-1H-IMIDAZOLE	A,B	2D0T	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A	1E9X	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHD	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A,B,C,D	2RFC	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A	1ODO	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A	3E5K	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHE	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A,B	1F4T	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A	1S1F	0.75
PIM	4-PHENYL-1H-IMIDAZOLE	A	1PHF	0.75
TAQ	2,4,6-TRIAMINOQUINAZOLINE	A,B,C,D,E,F,G,H	1W0C	0.74
JI2	N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine	A,B	3B3N	0.72
JI2	N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine	A,B	3DQR	0.72
PHN	1,10-PHENANTHROLINE	A	1LIH	0.87
PHN	1,10-PHENANTHROLINE	A	2LIG	0.87
PHN	1,10-PHENANTHROLINE	A,B	2FU7	0.87
793	3-{[(1R)-1-phenylethyl]amino}-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione	A	3FPM	0.71
GW3	7-(1-ETHYL-PROPYL)-7H-PYRROLO-[3,2-F]QUINAZOLINE-1,3-DIAMINE	A,B	1AOE	0.73
3MP	3-METHYLPYRIDINE	A	1EUB	0.71
3MP	3-METHYLPYRIDINE	A	1BM6	0.71
F11	N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLPENTANE-1,5-DIAMINE	A	2CMF	0.75
5MB	5-METHYLBENZIMIDAZOLE	A	1JHM	0.73
KSL	N-(2,6-dimethylphenyl)-5-phenylimidazo[1,5-a]pyrazin-8-amine	A	2ZYB	0.73
NPH	CYSTEINE-METHYLENE-CARBAMOYL-1,10-PHENANTHROLINE	A	1A18	0.72
DX2	6-phenylpteridine-2,4,7-triamine	A,B,C,D	3BME	0.7
STS	2-[(1S)-1-BENZYL-2-SULFANYLETHYL]-1H-IMIDAZO[4,5-C]PYRIDIN-5-IUM	A	1Y8J	0.74
RW1	4-phenylpyrimidine	A,B,C	3B9S	0.76
IQS	N-[2-(METHYLAMINO)ETHYL]-5-ISOQUINOLINESULFONAMIDE	E	1YDS	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
CLQ	N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE	A	1CET	0.78
SC9	6-(2-fluorophenyl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine	A	2R3G	0.71
760	9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE	A	1DX4	0.77
1CM	(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDE	A	2CI0	0.72
3B3	(2S)-1-AMINO-3-[(5-NITROQUINOLIN-8-YL)AMINO]PROPAN-2-OL	A	2CGV	0.78
IND	INDOLE	A	1L4H	0.76
IND	INDOLE	A,B,G	1O7N	0.76
IND	INDOLE	A	185L	0.76
IND	INDOLE	A,B	1EG9	0.76
IND	INDOLE	A,B	1UUV	0.76
IND	INDOLE	A,C,E	2B24	0.76
IND	INDOLE	A,B,C,D,E,F	2P85	0.76
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
NTN	ISONICOTINAMIDINE	A	7ADH	0.73