Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00022518

Ligand	Ligand name	Chain	PDB	Tanimoto
PRY	2-PROPYL-ANILINE	A	1OWY	0.97
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.75
ASR	4-AMINOPHENYLARSONIC ACID	A	1N4F	0.83
MAZ	FORMIC ACID 3-AMINO-BENZYL ESTER	H,L	1JYQ	0.71
5NS	5-aminonaphthalene-1-sulfonic acid	A,B	3CFT	0.71
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.76
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.76
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.74
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.74
34A	3,4-DIMETHYLANILINE	A	1L4K	0.96
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.76
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.76
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.73
NBE	NITROSOBENZENE	A	1LH7	0.76
NBE	NITROSOBENZENE	A	2LH7	0.76
NBE	NITROSOBENZENE	A	2NSS	0.76
BAM	BENZAMIDINE	U	1F5K	0.71
BAM	BENZAMIDINE	X	2BY8	0.71
BAM	BENZAMIDINE	B	2PSM	0.71
BAM	BENZAMIDINE	X	2BY9	0.71
BAM	BENZAMIDINE	A	1C1N	0.71
BAM	BENZAMIDINE	X	2BY6	0.71
BAM	BENZAMIDINE	H,I	1C5O	0.71
BAM	BENZAMIDINE	A	1XX4	0.71
BAM	BENZAMIDINE	A	1HJ8	0.71
BAM	BENZAMIDINE	A	1C5P	0.71
BAM	BENZAMIDINE	B	1C5Z	0.71
BAM	BENZAMIDINE	A,B	1ZVW	0.71
BAM	BENZAMIDINE	A	2ANW	0.71
BAM	BENZAMIDINE	A	2ANY	0.71
BAM	BENZAMIDINE	X	2BYA	0.71
BAM	BENZAMIDINE	A	1TIO	0.71
BAM	BENZAMIDINE	X	2BY5	0.71
BAM	BENZAMIDINE	X	2BY7	0.71
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.72
PHZ	1-PHENYLHYDRAZINE	A	2E2T	0.78
PHZ	1-PHENYLHYDRAZINE	D,H	2AGL	0.78
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.74
TFM	S-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREA	A,B	1K2U	0.77
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.96
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.96
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.96
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.96
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.78
U12	5-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)-5H-PYRAZOL-3-YLAMINE	A	2GG2	0.75
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.72
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.72
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.72
1MR	N-METHYLANILINE	X	2OTZ	0.77
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.75
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.75
ANL	ANILINE	A	2OV4	0.84
ANL	ANILINE	A	1AEE	0.84
ANL	ANILINE	A	1PPA	0.84
ANL	ANILINE	A	1HJ9	0.84
FPR	PROPYLBENZENE	C	1RHK	0.7
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.79
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.79
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.89
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.75
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.75
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.75
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.75
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.75
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.78
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.78
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.78
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.78
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.78
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.78
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.78
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.78
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.73
NBZ	NITROBENZENE	A,B	2BMQ	0.71
NBZ	NITROBENZENE	A,B	3BGU	0.71
G1L	3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A,B	2I80	0.73
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.85
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.85
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	2BDI	0.85
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.85
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.85
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.85
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.85
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.75
BEN	BENZAMIDINE	A	2TIO	0.71
BEN	BENZAMIDINE	A	1J15	0.71
BEN	BENZAMIDINE	A,B	3BEU	0.71
BEN	BENZAMIDINE	T	1V2U	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF8	0.71
BEN	BENZAMIDINE	A	1S0R	0.71
BEN	BENZAMIDINE	A,B	1V16	0.71
BEN	BENZAMIDINE	A	1CC7	0.71
BEN	BENZAMIDINE	A	3BG8	0.71
BEN	BENZAMIDINE	A	1CC8	0.71
BEN	BENZAMIDINE	A	3PTB	0.71
BEN	BENZAMIDINE	A,B	1TRM	0.71
BEN	BENZAMIDINE	A	1ZHR	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	1NKZ	0.71
BEN	BENZAMIDINE	A	2BLV	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLP	0.71
BEN	BENZAMIDINE	H,I	3D49	0.71
BEN	BENZAMIDINE	H,L,T	2AER	0.71
BEN	BENZAMIDINE	A	1J14	0.71
BEN	BENZAMIDINE	A	1NSA	0.71
BEN	BENZAMIDINE	A	2AYW	0.71
BEN	BENZAMIDINE	A	1BRA	0.71
BEN	BENZAMIDINE	A,B,C,D	1A0J	0.71
BEN	BENZAMIDINE	B,C,D	2AST	0.71
BEN	BENZAMIDINE	A,B	2CKR	0.71
BEN	BENZAMIDINE	A	1LPU	0.71
BEN	BENZAMIDINE	A	1ZHM	0.71
BEN	BENZAMIDINE	A	1J8A	0.71
BEN	BENZAMIDINE	A,B	3BCX	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3CF9	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3D04	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLL	0.71
BEN	BENZAMIDINE	A	1AND	0.71
BEN	BENZAMIDINE	A	2TBS	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP2	0.71
BEN	BENZAMIDINE	T	1V2M	0.71
BEN	BENZAMIDINE	A	2EEK	0.71
BEN	BENZAMIDINE	H,I	2ZI2	0.71
BEN	BENZAMIDINE	T	1V2J	0.71
BEN	BENZAMIDINE	H	1KLI	0.71
BEN	BENZAMIDINE	A	1CE5	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3B7J	0.71
BEN	BENZAMIDINE	B,Y	2PKA	0.71
BEN	BENZAMIDINE	A	2VJ0	0.71
BEN	BENZAMIDINE	A	3B3J	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOY	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP3	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	2GLM	0.71
BEN	BENZAMIDINE	A	1ANB	0.71
BEN	BENZAMIDINE	A	1LO6	0.71
BEN	BENZAMIDINE	A	1LR4	0.71
BEN	BENZAMIDINE	A,B	1V1M	0.71
BEN	BENZAMIDINE	A	1ZHP	0.71
BEN	BENZAMIDINE	A	2J9N	0.71
BEN	BENZAMIDINE	A	2BMV	0.71
BEN	BENZAMIDINE	A,B	2CKS	0.71
BEN	BENZAMIDINE	A	2BLW	0.71
BEN	BENZAMIDINE	A	1J16	0.71
BEN	BENZAMIDINE	A,B	1V11	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP0	0.71
BEN	BENZAMIDINE	B	1RTF	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DP1	0.71
BEN	BENZAMIDINE	A,B,C,D	2E58	0.71
BEN	BENZAMIDINE	A	2TRM	0.71
BEN	BENZAMIDINE	T	1V2V	0.71
BEN	BENZAMIDINE	A	1MBQ	0.71
BEN	BENZAMIDINE	A,B,C,D,E,F	3DOZ	0.71
BEN	BENZAMIDINE	A	2O8U	0.71
BEN	BENZAMIDINE	H	1DWB	0.71
BEN	BENZAMIDINE	B,C	2ASS	0.71
BEN	BENZAMIDINE	A	1ANE	0.71
BEN	BENZAMIDINE	H,I	2ZIQ	0.71
BEN	BENZAMIDINE	A	1BIT	0.71
BEN	BENZAMIDINE	A	2AIQ	0.71
BEN	BENZAMIDINE	A	2OQ5	0.71
BEN	BENZAMIDINE	A	1ANC	0.71
BEN	BENZAMIDINE	H	1JBU	0.71
BEN	BENZAMIDINE	A,B	2BPQ	0.71
BEN	BENZAMIDINE	A,B,C,D	2GNN	0.71
BEN	BENZAMIDINE	T	1V2S	0.71
BEN	BENZAMIDINE	A	1H4W	0.71
BEN	BENZAMIDINE	A	1OSS	0.71
BEN	BENZAMIDINE	A	1W80	0.71
BEN	BENZAMIDINE	A	1BTY	0.71
BEN	BENZAMIDINE	H,I	2ZFQ	0.71
BEN	BENZAMIDINE	A	1EAX	0.71
BEN	BENZAMIDINE	A	1L2E	0.71
BEN	BENZAMIDINE	A	1WRI	0.71
BEN	BENZAMIDINE	A,B	3BB8	0.71
BEN	BENZAMIDINE	A	2OXS	0.71
BEN	BENZAMIDINE	A	1DPO	0.71
BEN	BENZAMIDINE	T	1V2L	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.9
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.9
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.9
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.9
SOA	ISATOIC ANHYDRIDE	A	1BIO	0.74
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.76
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.76
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.9
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.79
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.79
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.79
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.79
NYL	N-ALLYL-ANILINE	A	1OVK	0.75
BRN	BERENIL	A,B	268D	0.77
BRN	BERENIL	A,B	1D63	0.77
BRN	BERENIL	A,D,E	2GBY	0.77
BRN	BERENIL	A	2DBE	0.77
BRN	BERENIL	A	2GVR	0.77
SAN	SULFANILAMIDE	A	1AJ0	0.71
264	(phenylamino)acetonitrile	A	2RBN	0.73
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.7
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
271	N-methyl-1-phenylmethanamine	X	2RBT	0.75
9AP	9-AMINOPHENANTHRENE	A	1EGY	0.81
AFF	2-ACETYLAMINOFLUORENE-3-YL	A	2GE2	0.75
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.91
4NM	4-NITROPHENYL METHANETHIOL	A,B	2VO4	0.76
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.71
3NT	3-NITROTOLUENE	A,B	2BMR	0.8
3NT	3-NITROTOLUENE	A,B	2HMO	0.8
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.76
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.76
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.73
1AN	2-FLUOROANILINE	A	1LGW	0.81
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.79
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.74
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.91
ANC	ANTHRACEN-1-YLAMINE	A,B	1GT1	0.8
ANC	ANTHRACEN-1-YLAMINE	A,B	1HN2	0.8
TNL	2,4,6-TRINITROTOLUENE	A	1GVR	0.75
APB	M-AMINOPHENYLBORONIC ACID	A,B	3BLS	0.83
BZZ	BENZYLHYDRAZINE	A,B	2E2V	0.71
IDM	INDOLINE	A,B	3CEP	0.78
IDM	INDOLINE	A	1AEK	0.78
U19	5-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)-5H-PYRAZOL-3-YLAMINE	A	2GG5	0.75
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.75
PTU	2-ETHYL-1-PHENYL-ISOTHIOUREA	A,B	1K2T	0.72
PTU	2-ETHYL-1-PHENYL-ISOTHIOUREA	A,B	1D1V	0.72
N2M	5-AMINO-NAPHTALENE-2-MONOSULFONATE	C,D	1HKN	0.71
ABN	BENZYLAMINE	D,H	2HXC	0.78
ABN	BENZYLAMINE	A,I	1A86	0.78
ABN	BENZYLAMINE	A	1UTN	0.78
ABN	BENZYLAMINE	A	1N6X	0.78
ABN	BENZYLAMINE	A	2BZA	0.78
ABN	BENZYLAMINE	A	2EUS	0.78
ABN	BENZYLAMINE	A	1N6Y	0.78
ABN	BENZYLAMINE	A	1UTJ	0.78
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.79
PYL	PHENYLETHANE	C	1B07	0.7
PYL	PHENYLETHANE	A,B	2VRM	0.7
PYL	PHENYLETHANE	A	1NHB	0.7
OCH	QUINOLIN-2(1H)-ONE	A,B,C,D,E,F	1Z03	0.72
DPK	DEPRENYL	A,B	2BYB	0.72
PL0	1-phenylguanidine	A	2O8W	0.7
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.71
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.73
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.72
N4B	N-BUTYLBENZENE	A	186L	0.7
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.94
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.94
2CM	2-CHLORO-6-METHYL-ANILINE	A	1OVH	0.8
NIT	4-NITROANILINE	C,D	1RMH	0.73
NIT	4-NITROANILINE	A,B,D,F,G,H,I	2IXP	0.73
NIT	4-NITROANILINE	B	1VBS	0.73
NIT	4-NITROANILINE	C	1V9T	0.73
NIT	4-NITROANILINE	C,D	1VBT	0.73
NIT	4-NITROANILINE	B	1LOP	0.73
NIT	4-NITROANILINE	C,D	1ZKF	0.73
NIT	4-NITROANILINE	B	1PIP	0.73
5AN	3,5-DIFLUOROANILINE	A	1LGX	0.79
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.8
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.8