Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00023170

Ligand	Ligand name	Chain	PDB	Tanimoto
PXY	PARA-XYLENE	A	187L	0.78
PXY	PARA-XYLENE	A	225L	0.78
SS1	1-PHENYLETHANOL	H	1UM5	0.77
MBN	TOLUENE	A,B	3D7O	0.78
MBN	TOLUENE	A,B	1R1X	0.78
MBN	TOLUENE	A,B	1JLX	0.78
MBN	TOLUENE	A,B,C,D	3D17	0.78
MBN	TOLUENE	A,B	2VRL	0.78
MBN	TOLUENE	A,I	2Z3E	0.78
MBN	TOLUENE	A,B	1YZI	0.78
MBN	TOLUENE	A,B	2DN1	0.78
MBN	TOLUENE	A,B	3EN1	0.78
PEL	2-PHENYL-ETHANOL	A,B	1I0D	0.8
PEL	2-PHENYL-ETHANOL	D,H	2I0T	0.8
PEL	2-PHENYL-ETHANOL	A,B	1HZY	0.8
PEL	2-PHENYL-ETHANOL	A,B	1I0B	0.8
PEL	2-PHENYL-ETHANOL	A	1EYW	0.8
PEL	2-PHENYL-ETHANOL	A,B	1JGM	0.8
2IB	2-IODOBENZYL GROUP	I,J,K,L,M,N,O,P	1GUL	0.73
PPP	3-PHENYL-1,2-PROPANDIOL	A,B	1HRN	0.77
PPY	3-PHENYLPYRUVIC ACID	A,B	2Q5O	0.72
PPY	3-PHENYLPYRUVIC ACID	A,B	1LCO	0.72
PPY	3-PHENYLPYRUVIC ACID	A,B,C,D,E,F	2ZF4	0.72
PPY	3-PHENYLPYRUVIC ACID	A,B	1BW9	0.72
IOB	3-IODO-BENZYL ALCOHOL	A,B	1QK0	0.71
HCI	HYDROCINNAMIC ACID	A,B	1BXG	0.74
HCI	HYDROCINNAMIC ACID	A,B	1TOG	0.74
HCI	HYDROCINNAMIC ACID	A,B	1V2F	0.74
HCI	HYDROCINNAMIC ACID	A,B	1AHX	0.74
HCI	HYDROCINNAMIC ACID	A	1TOI	0.74
HCI	HYDROCINNAMIC ACID	A,B	1AY8	0.74
HCI	HYDROCINNAMIC ACID	A	1TOJ	0.74
CLT	4-PHENYL-BUTANOIC ACID	A	1THL	0.73
CLT	4-PHENYL-BUTANOIC ACID	A,B	2AY7	0.73
CLT	4-PHENYL-BUTANOIC ACID	E,I	1TMN	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A	1OS0	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJI	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJJ	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2VS2	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	1OD1	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	E	1EPR	0.73
PFL	2,6-BIS(1-METHYLETHYL)PHENOL	A,B	1E7A	0.71
CRS	M-CRESOL	A,B,C,D	1EV3	0.72
CRS	M-CRESOL	A,B,C,D,E,F	2OMG	0.72
CRS	M-CRESOL	A,B	1UZ9	0.72
CRS	M-CRESOL	A,B,C,D	1ZEH	0.72
CRS	M-CRESOL	A,B,C,D,E,F	1ZEI	0.72
CRS	M-CRESOL	A,C,D,E	7INS	0.72
CRS	M-CRESOL	A,B,C,D,E,G,I,K	1EV6	0.72
PAC	2-PHENYLACETIC ACID	B	1PNL	0.71
PAC	2-PHENYLACETIC ACID	B	1K5Q	0.71
PAC	2-PHENYLACETIC ACID	B	1FXH	0.71
PAC	2-PHENYLACETIC ACID	A	2ISF	0.71
PAC	2-PHENYLACETIC ACID	A	2INE	0.71
EPT	HEPTANYL-P-PHENOL	A,B	1AHZ	0.72
5PV	5-PHENYLVALERIC ACID	A,B	2AY9	0.73
KPV	5-PHENYL-2-KETO-VALERIC ACID	A,B	2Q5Q	0.72
IBP	IBUPROFEN	A	3FKX	0.7
IBP	IBUPROFEN	A,B	2BXG	0.7
IBP	IBUPROFEN	A,B	1EQG	0.7
IBP	IBUPROFEN	A,B,C	2WD9	0.7
IBP	IBUPROFEN	A	2PWS	0.7
2LP	2-ALLYLPHENOL	A	1OV5	0.71
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1DPM	0.72
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1P6B	0.72
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1PSC	0.72
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	3E3H	0.72
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1QW7	0.72
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1P6C	0.72
PPT	3-(P-TOLYL)PROPIONIC ACID	A,B	2AY4	0.73
BDB		A,B	1KE3	0.72
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.7
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.7
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.7
FPR	PROPYLBENZENE	C	1RHK	0.78
DEN	INDENE	A	183L	0.7
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A,B	2P0M	0.75
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A	1LOX	0.75
8PP	2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-2,6,10,14,18,22,26,30-OCTAENYL]PHENOL	A,B,C,D	1Y0G	0.71
2HR	HEXYLPHOSPHONIC ACID (R)-2-METHYL-3-PHENYLPROPYL ESTER	X	1YS1	0.71
2HS	HEXYLPHOSPHONIC ACID (S)-2-METHYL-3-PHENYLPROPYL ESTER	X	1YS2	0.71
LYL	2-ALLYL-6-METHYL-PHENOL	A	1OV7	0.71
OBZ	O-benzylhydroxylamine	A,B	3DTH	0.7
OBZ	O-benzylhydroxylamine	A,B	3DTG	0.7
12M	(2-ETHYLPHENYL)METHANOL	A,B	2F62	0.74
SS2	(1R)-1-PHENYLETHANOL	A	1ZK0	0.77
SS2	(1R)-1-PHENYLETHANOL	A	1ZJZ	0.77
SS2	(1R)-1-PHENYLETHANOL	A	1ZJY	0.77
I4B	ISOBUTYLBENZENE	A	184L	0.76
CVB	4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID	A,B	1KE0	0.71
4FA	4-FLUOROPHENETHYL ALCOHOL	A	1OWZ	0.77
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.74
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.78
ETY	4-ethylphenol	A,B,C,D	2RA6	0.73
OXE	ORTHO-XYLENE	A,B	3E0X	0.76
OXE	ORTHO-XYLENE	A	188L	0.76
TCA	PHENYLETHYLENECARBOXYLIC ACID	A	1BE6	0.72
TCA	PHENYLETHYLENECARBOXYLIC ACID	A	1BE8	0.72
TCA	PHENYLETHYLENECARBOXYLIC ACID	A,B,C,D,E,F,G,H	2O78	0.72
PYL	PHENYLETHANE	C	1B07	0.78
PYL	PHENYLETHANE	A,B	2VRM	0.78
PYL	PHENYLETHANE	A	1NHB	0.78
PCR	P-CRESOL	A	1JHV	0.73
PCR	P-CRESOL	A	1JHU	0.73
PCR	P-CRESOL	A,B,C,D	1DIQ	0.73
N4B	N-BUTYLBENZENE	A	186L	0.78
PTF	[(METHYLSULFANYL)METHYL]BENZENE	C,F	1RHQ	0.71