Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00006827

Ligand	Ligand name	Chain	PDB	Tanimoto
PIV	PIVALIC ACID	B,D,F,H	1SMR	0.77
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B	1KTA	0.82
KIV	3-METHYL-2-OXOBUTANOIC ACID	A	1HJG	0.82
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B	1SR9	0.82
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B,C,D,E	1O68	0.82
BUA	BUTANOIC ACID	A	2CZ0	0.83
BUA	BUTANOIC ACID	A	1P0I	0.83
BUA	BUTANOIC ACID	A,B	2HA7	0.83
BUA	BUTANOIC ACID	A	1UK7	0.83
BUA	BUTANOIC ACID	A	2J4C	0.83
BUA	BUTANOIC ACID	A	1ZRM	0.83
BUA	BUTANOIC ACID	A	3DLT	0.83
BUA	BUTANOIC ACID	A	1UGP	0.83
BUA	BUTANOIC ACID	A,B	2CZ1	0.83
IVA	ISOVALERIC ACID	A	1YOO	0.93
IVA	ISOVALERIC ACID	E,I	4ER2	0.93
IVA	ISOVALERIC ACID	E,I	1APU	0.93
IVA	ISOVALERIC ACID	E,I	1APW	0.93
IVA	ISOVALERIC ACID	E,I	1APT	0.93
IVA	ISOVALERIC ACID	A	2D5Y	0.93
IVA	ISOVALERIC ACID	A,I	1GA4	0.93
IVA	ISOVALERIC ACID	E,I	1PPK	0.93
IVA	ISOVALERIC ACID	A,B,C,D	1QS8	0.93
IVA	ISOVALERIC ACID	A,B,C	1NLU	0.93
IVA	ISOVALERIC ACID	A,B	2RMP	0.93
IVA	ISOVALERIC ACID	A,B	1KE1	0.93
IVA	ISOVALERIC ACID	E,I	1PPL	0.93
IVA	ISOVALERIC ACID	A,B,C,D,I,J	1LYB	0.93
IVA	ISOVALERIC ACID	A	2D64	0.93
IVA	ISOVALERIC ACID	I	2ER0	0.93
IVA	ISOVALERIC ACID	I	1QRP	0.93
IVA	ISOVALERIC ACID	E,I	1APV	0.93
IVA	ISOVALERIC ACID	A,B	1KDZ	0.93
IVA	ISOVALERIC ACID	A	1UK9	0.93
IVA	ISOVALERIC ACID	A,I	1WKR	0.93
IVA	ISOVALERIC ACID	A,I	3FNT	0.93
IVA	ISOVALERIC ACID	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	3FV3	0.93
IVA	ISOVALERIC ACID	I	1PSO	0.93
IVA	ISOVALERIC ACID	I	6APR	0.93
IVA	ISOVALERIC ACID	A	2D63	0.93
SMB	2-METHYLBUTANOIC ACID	A,B,C	1YA8	0.93
SMB	2-METHYLBUTANOIC ACID	A	1UKA	0.93
2PP	2-PROPYL-PENTANOIC ACID	P	1DIT	0.81
LML	ISOBUTYL MALONIC ACID	A	1BFW	0.76
VAD	DEAMINOHYDROXYVALINE	C	1CWO	0.71
CCM	1-METHYL-1-CARBOXY-CYCLOPENTANE	A	1THL	0.72
0PA	cyclopentylacetic acid	A,B	3DWR	0.7
4MV	4-METHYL VALERIC ACID	A,B,C	1I1M	0.88
4MV	4-METHYL VALERIC ACID	A,B,C	2EIY	0.88
4MV	4-METHYL VALERIC ACID	A	2ECO	0.88
4MV	4-METHYL VALERIC ACID	A,C,D	1UMC	0.88
4MV	4-METHYL VALERIC ACID	A,B	2COG	0.88
SHF	LAEVULINIC ACID	A	1YLV	0.71
SHF	LAEVULINIC ACID	A	1H7N	0.71
6NA	HEXANOIC ACID	A,B	2IX4	0.74
6NA	HEXANOIC ACID	A,B	2IWZ	0.74
6NA	HEXANOIC ACID	A	2IQ0	0.74
COI	2-OXO-4-METHYLPENTANOIC ACID	A,B	1QS0	0.78
COI	2-OXO-4-METHYLPENTANOIC ACID	A,C	1UMD	0.78
COI	2-OXO-4-METHYLPENTANOIC ACID	A	1DXY	0.78
COI	2-OXO-4-METHYLPENTANOIC ACID	A,B	2HDK	0.78
COI	2-OXO-4-METHYLPENTANOIC ACID	A	1HJF	0.78
MAH	3-HYDROXY-3-METHYL-GLUTARIC ACID	A,B,C,D	1DQA	0.7
MAH	3-HYDROXY-3-METHYL-GLUTARIC ACID	A,B,C,D	1DQ8	0.7
SIF	3-TRIMETHYLSILYLSUCCINIC ACID	A,B	1FUQ	0.73
DTG	DES-AMINO T-BUTYL GLYCINE	A,B,C,D	2WPO	0.84
TRC	TRICARBALLYLIC ACID	A	6ACN	0.74
TRC	TRICARBALLYLIC ACID	A,B	2PW0	0.74
TRC	TRICARBALLYLIC ACID	A	5ACN	0.74
ALQ	2-METHYL-PROPIONIC ACID	C,D	1FKN	0.83
ALQ	2-METHYL-PROPIONIC ACID	C,D	2ZHR	0.83
ALQ	2-METHYL-PROPIONIC ACID	A	1IUP	0.83
ALQ	2-METHYL-PROPIONIC ACID	C,D	1M4H	0.83
ALQ	2-METHYL-PROPIONIC ACID	A	1R6N	0.83
ALQ	2-METHYL-PROPIONIC ACID	E,F,G,H	1XN2	0.83
LEA	LEVULINIC ACID	P	1VWR	0.81
LEA	LEVULINIC ACID	M,P	1VWJ	0.81
LEA	LEVULINIC ACID	A,B	1W1Z	0.81
LEA	LEVULINIC ACID	A,B	1B4K	0.81
LEA	LEVULINIC ACID	M,P	1VWK	0.81
LEA	LEVULINIC ACID	P	1VWQ	0.81
LEA	LEVULINIC ACID	A	1UK8	0.81
LEA	LEVULINIC ACID	M,P	1VWL	0.81
LEA	LEVULINIC ACID	M,P	1VWI	0.81
LEA	LEVULINIC ACID	A	1B4E	0.81
SLE	2-(THIOMETHYLENE)-4-METHYLPENTANOIC ACID	A,B	1ATL	0.74