MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00344822

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
DIQ	2-METHYL-DECAHYDRO-ISOQUINOLINE- 3-CARBOXYLIC ACID	A,B	1HXB	0.86
DIQ	2-METHYL-DECAHYDRO-ISOQUINOLINE- 3-CARBOXYLIC ACID	A,B	2FGU	0.86
DIQ	2-METHYL-DECAHYDRO-ISOQUINOLINE- 3-CARBOXYLIC ACID	A,B	2FGV	0.86
DIQ	2-METHYL-DECAHYDRO-ISOQUINOLINE- 3-CARBOXYLIC ACID	A,B	1MTB	0.86
CPI	6-CARBOXYPIPERIDINE	A,B,C,D,F,Q	1EFR	0.72
CPI	6-CARBOXYPIPERIDINE	B	1EOL	0.72
CPI	6-CARBOXYPIPERIDINE	B	1EOJ	0.72
CPI	6-CARBOXYPIPERIDINE	A,B,C,D,E,F, G,H,I,J,K,L	1W3M	0.72
CPI	6-CARBOXYPIPERIDINE	A,B	2ITK	0.72
CPI	6-CARBOXYPIPERIDINE	A,B	2Q5A	0.72
APP	1-ACETYL-2-CARBOXYPIPERIDINE	A,B,C,D,F,Q	1EFR	0.75
1PI	3-(1-CARBAMIMIDOYL-PIPERIDIN-3- YL)-L-ALANINE	A,B	1ZZZ	0.7
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5Z	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	5GDS	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2A2X	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FEQ	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2ANK	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,C,D	3DPP	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1EB1	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1NZQ	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1HBT	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D6E	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B	1B3H	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FES	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	C,D,E,G,H	3DPQ	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1THS	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1QUR	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D	3DPO	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	4THN	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,D	1D5M	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1O0D	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1YWH	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1XRZ	0.74
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5X	0.74
DM0	N~2~,N~2~,N~6~,N~6~-tetramethyl- L-lysine	A	132L	0.73
ZAL	3-cyclohexyl-D-alanine	I	1HBT	0.74
MCP	2-CARBOXY-4-METHYLPIPERIDINE	H	1ETR	0.75
3GA	3-PIPERIDYL-N-GUANIDINO-L-ALANINE	B,C	1BB0	0.7
3GA	3-PIPERIDYL-N-GUANIDINO-L-ALANINE	1	1YYY	0.7
3GA	3-PIPERIDYL-N-GUANIDINO-L-ALANINE	B,C	1CA8	0.7
MNL	4,N-DIMETHYLNORLEUCINE	C	1CWC	0.72
CHG	CYCLOHEXYL-GLYCINE	2,3,4	8KME	0.72
CHG	CYCLOHEXYL-GLYCINE	H,I	4THN	0.72
CHG	CYCLOHEXYL-GLYCINE	H,I,J	7KME	0.72
CHG	CYCLOHEXYL-GLYCINE	H,I	5GDS	0.72
LP6	6-piperidin-1-yl-L-norleucine	A,B	2W7Z	0.73