Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00004944

Ligand	Ligand name	Chain	PDB	Tanimoto
3NT	3-NITROTOLUENE	A,B	2BMR	0.74
3NT	3-NITROTOLUENE	A,B	2HMO	0.74
TNS		A,B,L	2G2R	0.76
PNC	PARA-NITROBENZYL GLUTARYL GLYCINIC ACID	L	1YEF	0.72
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A,B,C,D	1PX0	0.75
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A,B,C,D	2ZHM	0.75
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO-ETHANOL	A	2ZHN	0.75
23N	(2R)-2-benzyl-3-nitropropanoic acid	A	2RFH	0.77
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.76
PPN	PARA-NITROPHENYLALANINE	I	1YTJ	0.88
4NM	4-NITROPHENYL METHANETHIOL	A,B	2VO4	0.72
MPQ	N-METHYL-ALPHA-PHENYL-GLYCINE	D	1D6E	0.7
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
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F,G,H	1F8S	0.76
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.76
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.76
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.76
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.76
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.76
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.76
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.76
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.76
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.76
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.76
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE-1,3-DIONE	A,B	1T47	0.75
1PA	PHENYLMETHYLACETIC ACID ALANINE	I	1BHF	0.72
PG9	D-PHENYLGLYCINE	A,B,G,H	10GS	0.75
PG9	D-PHENYLGLYCINE	A,B,C,D	2B4K	0.75
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.87
CBL	CHLORAMBUCIL	A,B	3CSJ	0.74
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.85
NID	4-NITRO-INDEN-1-ONE	A,B	1DOH	0.74
RNO	(R)-PARA-NITROSTYRENE OXIDE	A,B,C,D	1ZMT	0.74
NPB	3-NITROPHENYLBORONIC ACID	A,B	1KDS	0.7
BPN	PARANITROBENZYL ALCOHOL	H,L	1YEG	0.79
2UN	{4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)-3-OXOPROPYL]PHENYL}SULFAMIC ACID	A,B	2H02	0.71
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.77
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.77
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.77
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.77
PRQ	(3S)-3-amino-3-(2-nitrophenyl)propanoic acid	C,F,I,L	2VE6	0.83
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1F42	0.79
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1RXE	0.79
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	2PER	0.79
NPE	5-(PARA-NITROPHENYL PHOSPHONATE)-PENTANOIC ACID	H	1GAF	0.72
NPE	5-(PARA-NITROPHENYL PHOSPHONATE)-PENTANOIC ACID	H	1AJ7	0.72
IBR		A	9EST	0.72
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A,B	2VJ1	0.73
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A	2V6N	0.73
MNP	2-(3-NITROPHENYL)ACETIC ACID	B	1AI5	0.95
SNO	(S)-PARA-NITROSTYRENE OXIDE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	1ZO8	0.74
NCR	2-NITRO-P-CRESOL	A,B	1AHV	0.7
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.71
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.71
TNL	2,4,6-TRINITROTOLUENE	A	1GVR	0.72
KYN	KYNURENINE	A,B,C,D	2R2N	0.72
KYN	KYNURENINE	A,B	3E2Z	0.72
KYN	KYNURENINE	A	1XT7	0.72
KYN	KYNURENINE	A	1T5M	0.72
KYN	KYNURENINE	A	1T5N	0.72
KYN	KYNURENINE	A	2VOV	0.72
KYN	KYNURENINE	A	2VOX	0.72
AAH		H	1KEL	0.78
AAH		B,H	1FL6	0.78
EAB	(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3T	0.79
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.8
NPC	4-HYDROXY-3-NITROPHENYLACETYL-EPSILON-AMINOCAPROIC ACID ANION	H,I,J	1A6V	0.71
53N	3-[5-(3-nitrophenyl)thiophen-2-yl]propanoic acid	A	3DN5	0.8
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3S	0.79
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B,C,D	2H4B	0.79
DOF	(S)-2-(4-NITROBENZYL)-1,4,7,10-TETRAAZACYCLODODECANE-N,N',N'',N'''-TETRAACETATE	A,B,C,D	1NC4	0.73
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.73
NIY	META-NITRO-TYROSINE	A	2ADP	0.76
NIY	META-NITRO-TYROSINE	A	3DIV	0.76
NIY	META-NITRO-TYROSINE	A	2H5U	0.76
NIY	META-NITRO-TYROSINE	A	1K4Q	0.76
NIY	META-NITRO-TYROSINE	B,G,O,Y	1SDA	0.76
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.77
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.77
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.77
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.77
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.77
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	1
PAC	2-PHENYLACETIC ACID	B	1PNL	0.72
PAC	2-PHENYLACETIC ACID	B	1K5Q	0.72
PAC	2-PHENYLACETIC ACID	B	1FXH	0.72
PAC	2-PHENYLACETIC ACID	A	2ISF	0.72
PAC	2-PHENYLACETIC ACID	A	2INE	0.72