Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00003900

Ligand	Ligand name	Chain	PDB	Tanimoto
NPC	4-HYDROXY-3-NITROPHENYLACETYL-EPSILON-AMINOCAPROIC ACID ANION	H,I,J	1A6V	0.73
4A3	4-AMINO-3-HYDROXYBENZOIC ACID	A,B	2HDR	0.74
4NL	4-AMINOPHENOL	A	2ORL	0.74
2AF	2-AMINOPHENOL	A	1L4N	0.79
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE-1,3-DIONE	A,B	1T47	0.7
NIP	4-HYDROXY-5-IODO-3-NITROPHENYLACETYL-EPSILON-AMINOCAPROIC ACID ANION	H	1A6W	0.7
NPE	5-(PARA-NITROPHENYL PHOSPHONATE)-PENTANOIC ACID	H	1GAF	0.71
NPE	5-(PARA-NITROPHENYL PHOSPHONATE)-PENTANOIC ACID	H	1AJ7	0.71
NPO	P-NITROPHENOL	A,B	1Z44	0.84
NPO	P-NITROPHENOL	X	2ZYW	0.84
NPO	P-NITROPHENOL	H,L	1YEK	0.84
NPO	P-NITROPHENOL	A,C,E,G	43CA	0.84
NPO	P-NITROPHENOL	A	1LS6	0.84
NPO	P-NITROPHENOL	X	2ZVP	0.84
NPO	P-NITROPHENOL	A,B	2I10	0.84
NPO	P-NITROPHENOL	A	1VAH	0.84
NPO	P-NITROPHENOL	A,B	3ETT	0.84
NPO	P-NITROPHENOL	A,B	2D20	0.84
NPO	P-NITROPHENOL	X	2ZYV	0.84
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
4NC	4-NITROCATECHOL	A	1NO3	0.77
4NC	4-NITROCATECHOL	B	2BUU	0.77
4NC	4-NITROCATECHOL	B	2BUZ	0.77
4NC	4-NITROCATECHOL	B	1EOC	0.77
CSN	N,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUM	P	1E2S	0.74
CSN	N,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUM	A	1PA9	0.74
TY2	3-AMINO-L-TYROSINE	A,B	2VH3	0.72
PNP	METHYL-PHOSPHONIC ACID MONO-(4-NITRO-PHENYL) ESTER	A,B,D,F	1KNO	0.76
PNP	METHYL-PHOSPHONIC ACID MONO-(4-NITRO-PHENYL) ESTER	A	1ZED	0.76
TNF	PICRIC ACID	A	1GVS	0.82
TNF	PICRIC ACID	X	1VYP	0.82
TNF	PICRIC ACID	A	1VYR	0.82
TNF	PICRIC ACID	X	1VYS	0.82
4NP	4-NITROPHENYL PHOSPHATE	A,B	1D1Q	0.76
4NP	4-NITROPHENYL PHOSPHATE	A,B	1VE7	0.76
4NP	4-NITROPHENYL PHOSPHATE	A	2I6P	0.76
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.71
EPN	3-(4-NITRO-PHENOXY)-PROPAN-1-OL	A	2SAM	0.71
RNO	(R)-PARA-NITROSTYRENE OXIDE	A,B,C,D	1ZMT	0.73
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	0.71
AZY	3-AZIDO-L-TYROSINE	A	2YXN	0.71
NIY	META-NITRO-TYROSINE	A	2ADP	0.78
NIY	META-NITRO-TYROSINE	A	3DIV	0.78
NIY	META-NITRO-TYROSINE	A	2H5U	0.78
NIY	META-NITRO-TYROSINE	A	1K4Q	0.78
NIY	META-NITRO-TYROSINE	B,G,O,Y	1SDA	0.78
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.72
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.72
DNT	2-[1-METHYLHEXYL]-4,6-DINITROPHENOL	A,B,C	1NEN	0.83
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.81
SNO	(S)-PARA-NITROSTYRENE OXIDE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	1ZO8	0.73
GN8	(Z)-3-BENZYL-5-(2-HYDROXY-3-NITROBENZYLIDENE)-2-THIOXOTHIAZOLIDIN-4-ONE	A,B,C,D,E,F	2P6F	0.7
B4N	bis(4-nitrophenyl) hydrogen phosphate	A	3DH8	0.72
2AC	2-AMINO-P-CRESOL	H,I	1A2C	0.84
2AC	2-AMINO-P-CRESOL	A	1L4M	0.84
DNF	2,4-DINITROPHENOL	A,B	2B16	0.85
DNF	2,4-DINITROPHENOL	H,J,L,N	1OAU	0.85
DNF	2,4-DINITROPHENOL	A	1GVO	0.85
DNF	2,4-DINITROPHENOL	A,B	2B15	0.85
DNF	2,4-DINITROPHENOL	A,B	2B14	0.85
BPN	PARANITROBENZYL ALCOHOL	H,L	1YEG	0.81
NCR	2-NITRO-P-CRESOL	A,B	1AHV	0.96
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A,B,C,D	1PX0	0.76
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A,B,C,D	2ZHM	0.76
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A	2ZHN	0.76
SAF	3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL	A	1GQR	0.7
SAF	3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL	A	1GQS	0.7
4NS	4-nitrophenyl sulfate	X	2ZYU	0.77
ANX	2,5-DINITROPHENOL	A,B,C,D,E,F,G,H	2BFG	0.84
BIE	(3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE	A,B	2CL5	0.71
DNC	3,5-DINITROCATECHOL	A	3BWY	0.78
DNC	3,5-DINITROCATECHOL	A	3BWM	0.78
DNC	3,5-DINITROCATECHOL	A	1VID	0.78
BRS	2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6-DINITRO-PHENOL	A,B,D,M,N,O,P	1KFY	0.77
NCH	P-NITROPHENYL-PHOSPHOCHOLINE	L	1DL7	0.71
3NT	3-NITROTOLUENE	A,B	2BMR	0.71
3NT	3-NITROTOLUENE	A,B	2HMO	0.71