Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00005558

Ligand	Ligand name	Chain	PDB	Tanimoto
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.72
NIY	META-NITRO-TYROSINE	A	2ADP	0.74
NIY	META-NITRO-TYROSINE	A	3DIV	0.74
NIY	META-NITRO-TYROSINE	A	2H5U	0.74
NIY	META-NITRO-TYROSINE	A	1K4Q	0.74
NIY	META-NITRO-TYROSINE	B,G,O,Y	1SDA	0.74
DMB		A,B	1SRI	0.77
A84	2-[({2-[(1Z)-3-(DIMETHYLAMINO)PROP-1-ENYL]-4-FLUOROPHENYL}SULFONYL)AMINO]-5,6,7,8-TETRAHYDRONAPHTHALENE-1-CARBOXYLIC ACID	A	1YW9	0.71
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.78
A41	5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID	A	1YW7	0.76
CFQ	1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-arsenocholine	A,B	2V97	0.71
CFQ	1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-arsenocholine	A,B	2V98	0.71
CFQ	1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-arsenocholine	A,B	2V96	0.71
MTB		A,B	1SRF	0.77
A75	2-[(PHENYLSULFONYL)AMINO]-5,6,7,8-TETRAHYDRONAPHTHALENE-1-CARBOXYLIC ACID	A	1YW8	0.75
HNA	1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE	A	1M2P	0.76
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.76
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.74
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.74
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3S	0.7
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B,C,D	2H4B	0.7
A80	N-(5,5,8,8-TETRAMETHYL-5,8-DIHYDRO-NAPHTHALEN-2-YL)-TEREPHTHALAMIC ACID	A	2CBR	0.71
3B4	2-(cyclohexylamino)benzoic acid	A,B	3B4P	0.76
NID	4-NITRO-INDEN-1-ONE	A,B	1DOH	0.75
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.87
NAB		A,B	1SRJ	0.74
MNP	2-(3-NITROPHENYL)ACETIC ACID	B	1AI5	0.83
BPN	PARANITROBENZYL ALCOHOL	H,L	1YEG	0.74
F77	3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}-2-METHYLBENZOIC ACID	A	2EA2	0.77
ICU	METHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATE	A	1JIM	0.72
BIE	(3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE	A,B	2CL5	0.72
HAB		A,B	1SRE	0.77
761	3-(OXALYL-AMINO)-NAPHTHALENE-2-CARBOXYLIC ACID	A	1C84	0.72
EAB	(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3T	0.7
MCG	(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE	A,B	1ISS	0.74
I3C	5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid	A	3GT4	0.7
I3C	5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid	A	3E3T	0.7
I3C	5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid	A	3E3D	0.7
I3C	5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid	A	3E3S	0.7
I3C	5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid	A	3E79	0.7
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A,B	1BM7	0.76
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	1S2C	0.76
FLF	2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID	A	2PIX	0.76
MRE	2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID	A,B	2V9C	0.78
TYZ	PARA ACETAMIDO BENZOIC ACID	B,C	2BNI	0.72
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5K	0.72
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5J	0.72
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.8
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.8
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.8
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.8
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	0.85
53N	3-[5-(3-nitrophenyl)thiophen-2-yl]propanoic acid	A	3DN5	0.71
794	2-[(CARBOXYCARBONYL)(1-NAPHTHYL)AMINO]BENZOIC ACID	A	1NO6	0.74
IBR		A	9EST	0.7
B23	5-(2-NITROPHENYL)-2-FUROIC ACID	A	2Q92	0.74
OFL	O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID	A	1DVZ	0.76
NCR	2-NITRO-P-CRESOL	A,B	1AHV	0.7
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE-1,3-DIONE	A,B	1T47	0.79
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1F42	0.88
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1RXE	0.88
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	2PER	0.88
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.77
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A,B	2VJ1	0.75
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A	2V6N	0.75
SX1	2-amino-5-bromobenzoic acid	A,B	3CIZ	0.78
PPN	PARA-NITROPHENYLALANINE	I	1YTJ	0.75
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A,B,C,D	1PX0	0.71
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A,B,C,D	2ZHM	0.71
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A	2ZHN	0.71
U14	3-(5-AMINO-3-IMINO-3H-PYRAZOL-4-YLAZO)-BENZOIC ACID	A	2GG7	0.73
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.78
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.78
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.78
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.78
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.78
SCL	ACETIC ACID SALICYLOYL-AMINO-ESTER	A	1EBV	0.7
OBA	2-(OXALYL-AMINO)-BENZOIC ACID	A	1C85	0.76
KYN	KYNURENINE	A,B,C,D	2R2N	0.73
KYN	KYNURENINE	A,B	3E2Z	0.73
KYN	KYNURENINE	A	1XT7	0.73
KYN	KYNURENINE	A	1T5M	0.73
KYN	KYNURENINE	A	1T5N	0.73
KYN	KYNURENINE	A	2VOV	0.73
KYN	KYNURENINE	A	2VOX	0.73
878	5-IODO-2-(OXALYL-AMINO)-BENZOIC ACID	A	1ECV	0.75
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F,G,H	1F8S	0.85
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.85
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.85
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.85
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.85
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.85
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.85
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.85
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.85
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.85
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.85
MHB		A,B	1SRG	0.78
PRQ	(3S)-3-amino-3-(2-nitrophenyl)propanoic acid	C,F,I,L	2VE6	0.76