Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02259028

Ligand	Ligand name	Chain	PDB	Tanimoto
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.84
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.74
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.74
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.74
NP2	N-(3-AMINOPROPYL)-2-NITROBENZENAMINE	A	1WUM	0.75
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.75
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.75
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.75
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.75
GEP	N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION	L	25C8	0.7
264	(phenylamino)acetonitrile	A	2RBN	0.9
APB	M-AMINOPHENYLBORONIC ACID	A,B	3BLS	0.7
1MR	N-METHYLANILINE	X	2OTZ	0.85
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1-DIOXIDE	A	2BGE	0.72
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.77
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.8
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.82
SC5	2-[((R)-{[4-(AMINOMETHYL)PHENYL]AMINO}{[(1R)-1-PHENYLETHYL]AMINO}METHYL)AMINO]ETHANE-1,1-DIOL	H	1YNK	0.73
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.72
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.72
EBW	4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-2-ENYLBENZENAMINIUM	A	1E3Q	0.74
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.74
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.74
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.74
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.78
W22	[(2S)-4-methyl-3-oxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-yl]acetic acid	A,B	2WKW	0.71
NYL	N-ALLYL-ANILINE	A	1OVK	0.87
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.71
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.71
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.84
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.81
271	N-methyl-1-phenylmethanamine	X	2RBT	0.79
A8B		A	1ODC	0.77
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.71
DPK	DEPRENYL	A,B	2BYB	0.71
12Q	1-METHYLQUINOLIN-2(1H)-ONE	A,B	2F64	0.75
ABN	BENZYLAMINE	D,H	2HXC	0.71
ABN	BENZYLAMINE	A,I	1A86	0.71
ABN	BENZYLAMINE	A	1UTN	0.71
ABN	BENZYLAMINE	A	1N6X	0.71
ABN	BENZYLAMINE	A	2BZA	0.71
ABN	BENZYLAMINE	A	2EUS	0.71
ABN	BENZYLAMINE	A	1N6Y	0.71
ABN	BENZYLAMINE	A	1UTJ	0.71
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.78
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.78
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.78
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.78
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.74
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A,B	1EK1	0.73
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A	1VJ5	0.73
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.7
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.72
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.75
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.75
G1L	3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A,B	2I80	0.75
UN6	(3-{[3-(3-SULFOAMINO-PHENYL)-PROPIONYLAMINO]-METHYL}-PHENYL)-SULFAMIC ACID	A	2F70	0.7
34A	3,4-DIMETHYLANILINE	A	1L4K	0.78
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.75
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.75
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.73
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.73
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	2BDI	0.73
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.73
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.73
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.73
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.73
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.73
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.73
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.73
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.73
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.73
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.73
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.73
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.86
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.86
BSU	1,3-DIPHENYLUREA	A	3E85	0.73
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.73
CXX	3-(3-CHLORO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q6H	0.73
CXX	3-(3-CHLORO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2QEI	0.73
IDM	INDOLINE	A,B	3CEP	0.89
IDM	INDOLINE	A	1AEK	0.89
PL0	1-phenylguanidine	A	2O8W	0.74
LGD	6-[BIS(2,2,2-TRIFLUOROETHYL)AMINO]-4-(TRIFLUOROMETHYL)QUINOLIN-2(1H)-ONE	A	2HVC	0.76
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.82
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.82
AFF	2-ACETYLAMINOFLUORENE-3-YL	A	2GE2	0.75
171	2-PHENYLAMINO-ETHANESULFONIC ACID	A,B	1SXG	0.75
44B	1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2-TRIFLUOROETHYL)AMINO]PHENYL}PROPAN-2-OL	A,B,C,D	1PQ9	0.7
ANL	ANILINE	A	2OV4	0.71
ANL	ANILINE	A	1AEE	0.71
ANL	ANILINE	A	1PPA	0.71
ANL	ANILINE	A	1HJ9	0.71
221	(2R,3R)-3-{[3,5-BIS(TRIFLUOROMETHYL)PHENYL]AMINO}-2-CYANO-3-THIOXOPROPANAMIDE	A,B	2IJN	0.76
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.73
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.73
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.71
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.71
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.71
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.71
MGR	MALACHITE GREEN	A,B	3BQZ	0.75
MGR	MALACHITE GREEN	A	1Q8N	0.75
MGR	MALACHITE GREEN	A,B	3BR0	0.75
MGR	MALACHITE GREEN	A,D,E	3BTL	0.75
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.75
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.75
2CM	2-CHLORO-6-METHYL-ANILINE	A	1OVH	0.71
34T	(3R)-8-(dioxidosulfanyl)-3-methyl-1,2,3,4-tetrahydroquinoline	H	1ETR	0.75
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.76
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.7
A26	2-CYANO-3-HYDROXY-N-(4-TRIFLUOROMETHYL-PHENYL)-BUTYRAMIDE	A	1TV5	0.71
A26	2-CYANO-3-HYDROXY-N-(4-TRIFLUOROMETHYL-PHENYL)-BUTYRAMIDE	A	1D3H	0.71
ASR	4-AMINOPHENYLARSONIC ACID	A	1N4F	0.7
OCH	QUINOLIN-2(1H)-ONE	A,B,C,D,E,F	1Z03	0.77
G3E	3-hydroxyquinolin-2(1H)-one	A,B,C,D	3G3E	0.7
PRY	2-PROPYL-ANILINE	A	1OWY	0.83
BEP	1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANE	C	1LXF	0.72
BEP	1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANE	A	1DTL	0.72
DR1	5-METHYL-5H-INDOLO[3,2-B]QUINOLINE	A	1K9G	0.73
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.75
LO1	[[4-(AMINOMETHYL)PHENYL]AMINO]OXO-ACETIC ACID,	A	1WAX	0.77
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.81
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.74
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.73
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.71