Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00043731

Ligand	Ligand name	Chain	PDB	Tanimoto
4A3	4-AMINO-3-HYDROXYBENZOIC ACID	A,B	2HDR	0.74
NPO	P-NITROPHENOL	A,B	1Z44	0.73
NPO	P-NITROPHENOL	X	2ZYW	0.73
NPO	P-NITROPHENOL	H,L	1YEK	0.73
NPO	P-NITROPHENOL	A,C,E,G	43CA	0.73
NPO	P-NITROPHENOL	A	1LS6	0.73
NPO	P-NITROPHENOL	X	2ZVP	0.73
NPO	P-NITROPHENOL	A,B	2I10	0.73
NPO	P-NITROPHENOL	A	1VAH	0.73
NPO	P-NITROPHENOL	A,B	3ETT	0.73
NPO	P-NITROPHENOL	A,B	2D20	0.73
NPO	P-NITROPHENOL	X	2ZYV	0.73
DMB		A,B	1SRI	0.72
GHP	4-HYDROXYPHENYLGLYCINE	A	1DSR	0.73
HAB		A,B	1SRE	0.73
TYQ	3-AMINO-6-HYDROXY-TYROSINE	A,B	1D6Y	0.77
TYQ	3-AMINO-6-HYDROXY-TYROSINE	A,B	1D6U	0.77
AZY	3-AZIDO-L-TYROSINE	A	2YXN	0.82
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.73
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.73
BPN	PARANITROBENZYL ALCOHOL	H,L	1YEG	0.72
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A,B,C,D	1PX0	0.73
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A,B,C,D	2ZHM	0.73
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A	2ZHN	0.73
MR2	3-DIPHENOL-6-NITRO-3H-BENZO[DE]ISOCHROMEN-1-ONE	A	1TSM	0.71
BIE	(3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE	A,B	2CL5	0.74
MTB		A,B	1SRF	0.72
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B	2TPL	0.7
HPP	HYDROXYPHENYL PROPIONIC ACID	A,B,C,D	3GGP	0.7
P28	3',5'-DINITRO-N-ACETYL-L-THYRONINE	A,B	2ROY	0.73
MNX	1,8-DI-HYDROXY-4-NITRO-XANTHEN-9-ONE	A	1M2Q	0.72
DNT	2-[1-METHYLHEXYL]-4,6-DINITROPHENOL	A,B,C	1NEN	0.8
LVS	4-IODO-3-NITROPHENYL ACETYL-LEUCINYL-LEUCINYL-LEUCINYL-VINYLSULFONE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V,W,X	1KYI	0.7
LVS	4-IODO-3-NITROPHENYL ACETYL-LEUCINYL-LEUCINYL-LEUCINYL-VINYLSULFONE	A,B,C,G,H,I,L,M,N	1OFI	0.7
B3Y	(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID	A	3HF0	0.7
B3Y	(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID	A	2OXK	0.7
B3Y	(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID	A,B,C	2OXJ	0.7
SCL	ACETIC ACID SALICYLOYL-AMINO-ESTER	A	1EBV	0.71
EPN	3-(4-NITRO-PHENOXY)-PROPAN-1-OL	A	2SAM	0.71
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE-1,3-DIONE	A,B	1T47	0.73
YOF	3-FLUOROTYROSINE	A,B	1XIL	0.7
YOF	3-FLUOROTYROSINE	A,B	1XDC	0.7
YOF	3-FLUOROTYROSINE	A	1RRX	0.7
YOF	3-FLUOROTYROSINE	A,B	3FYG	0.7
DGH	(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F,G,H,I,J,K,L	1W7Q	0.73
DGH	(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F,G,H	1W7R	0.73
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.92
2TY	2-HYDROXY-5-{[(1E)-2-PHENYLETHYLIDENE]AMINO}-L-TYROSINE	A,B	2CWV	0.71
BRS	2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6-DINITRO-PHENOL	A,B,D,M,N,O,P	1KFY	0.75
MHB		A,B	1SRG	0.74
MNP	2-(3-NITROPHENYL)ACETIC ACID	B	1AI5	0.77
DTY	D-TYROSINE	A	1C4B	0.72
DTY	D-TYROSINE	A,L	1ZEA	0.72
DTY	D-TYROSINE	A,B,C,D,E,F,G,H	1OF6	0.72
DTY	D-TYROSINE	A,B	1UNO	0.72
DTY	D-TYROSINE	A	2IGZ	0.72
DTY	D-TYROSINE	A,B,C,H,K,L	2R5D	0.72
DTY	D-TYROSINE	A,B	2Q33	0.72
DTY	D-TYROSINE	H,S	2H9E	0.72
DTY	D-TYROSINE	A,B,C,H,K,L	2R5B	0.72
DTY	D-TYROSINE	A	2IH0	0.72
DTY	D-TYROSINE	A	1D7T	0.72
DTY	D-TYROSINE	A,B	1XA0	0.72
CFQ	1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-arsenocholine	A,B	2V97	0.72
CFQ	1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-arsenocholine	A,B	2V98	0.72
CFQ	1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-arsenocholine	A,B	2V96	0.72
247	(3R)-3-amino-2,2-difluoro-3-(4-hydroxyphenyl)propanoic acid	A,B	2QVE	0.7
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.75
NIY	META-NITRO-TYROSINE	A	2ADP	0.9
NIY	META-NITRO-TYROSINE	A	3DIV	0.9
NIY	META-NITRO-TYROSINE	A	2H5U	0.9
NIY	META-NITRO-TYROSINE	A	1K4Q	0.9
NIY	META-NITRO-TYROSINE	B,G,O,Y	1SDA	0.9
ST1	4-(ACETYLAMINO)-3-HYDROXY-5-NITROBENZOIC ACID	A,B	1IVD	0.71
ST1	4-(ACETYLAMINO)-3-HYDROXY-5-NITROBENZOIC ACID	A	1IVB	0.71
HNA	1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE	A	1M2P	0.7
NPC	4-HYDROXY-3-NITROPHENYLACETYL-EPSILON-AMINOCAPROIC ACID ANION	H,I,J	1A6V	0.83
DNF	2,4-DINITROPHENOL	A,B	2B16	0.75
DNF	2,4-DINITROPHENOL	H,J,L,N	1OAU	0.75
DNF	2,4-DINITROPHENOL	A	1GVO	0.75
DNF	2,4-DINITROPHENOL	A,B	2B15	0.75
DNF	2,4-DINITROPHENOL	A,B	2B14	0.75
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1F42	0.71
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1RXE	0.71
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	2PER	0.71
NIP	4-HYDROXY-5-IODO-3-NITROPHENYLACETYL-EPSILON-AMINOCAPROIC ACID ANION	H	1A6W	0.8
NPE	5-(PARA-NITROPHENYL PHOSPHONATE)-PENTANOIC ACID	H	1GAF	0.75
NPE	5-(PARA-NITROPHENYL PHOSPHONATE)-PENTANOIC ACID	H	1AJ7	0.75
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	0.78
ANX	2,5-DINITROPHENOL	A,B,C,D,E,F,G,H	2BFG	0.74
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A	1DSR	0.73
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F,G,H	1W7R	0.73
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F,G,H,I,J,K,L	1W7Q	0.73
TY2	3-AMINO-L-TYROSINE	A,B	2VH3	0.83
TNF	PICRIC ACID	A	1GVS	0.73
TNF	PICRIC ACID	X	1VYP	0.73
TNF	PICRIC ACID	A	1VYR	0.73
TNF	PICRIC ACID	X	1VYS	0.73
2AC	2-AMINO-P-CRESOL	H,I	1A2C	0.77
2AC	2-AMINO-P-CRESOL	A	1L4M	0.77
NCR	2-NITRO-P-CRESOL	A,B	1AHV	0.85
IYR	3-IODO-TYROSINE	A	2D98	0.7
IYR	3-IODO-TYROSINE	A	2D8P	0.7
IYR	3-IODO-TYROSINE	A,B	3GFD	0.7
IYR	3-IODO-TYROSINE	A	2R1Q	0.7
IYR	3-IODO-TYROSINE	A	2ZP1	0.7
IYR	3-IODO-TYROSINE	A,B,C,D	2ZXV	0.7
IYR	3-IODO-TYROSINE	C	1CF0	0.7
IYR	3-IODO-TYROSINE	A	1XXZ	0.7
IYR	3-IODO-TYROSINE	A	2D97	0.7
IYR	3-IODO-TYROSINE	A	1XY9	0.7
IYR	3-IODO-TYROSINE	A	2Z10	0.7
IYR	3-IODO-TYROSINE	A	1WQ3	0.7
IYR	3-IODO-TYROSINE	A	2D8O	0.7
IYR	3-IODO-TYROSINE	A	2D8W	0.7
IYR	3-IODO-TYROSINE	A	2Z11	0.7
PPN	PARA-NITROPHENYLALANINE	I	1YTJ	0.74