MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02243583

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
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	B	2EI5	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2OB3	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2W1Q	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	1XA4	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2I3H	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2RI1	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	1XA3	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2I3G	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2C59	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2C5A	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2IC5	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2ONG	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C,D	3EHU	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2F07	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	3GG4	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	1AG9	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	B	3BD3	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,C,D,F,G	2HVR	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A	2NUI	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,C,D,F,G	2HVS	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2RI0	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	3BD4	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C,D	1JZ2	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	1TW6	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C,D	2YVD	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C,D	1JZ3	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C	2E3V	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C,D	1R64	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	3BD5	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	3F7I	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2OQL	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C,D	1RJ4	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	3F7H	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	3CAK	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A	2VN4	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A	2VN7	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2I3I	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,E	3DHH	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	1VCL	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C	3DHI	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C,D	2I3A	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	1N1Z	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2V3F	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A	2BIB	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B,C,D,E	3F6W	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2ONH	0.77
BTB	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]- 2-HYDROXYMETHYL-PROPANE-1,3-DIOL	A,B	2W1S	0.77
EDT	{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]- CARBOXYMETHYL-AMINO}-ACETIC ACID	A	2AXN	0.7
EDT	{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]- CARBOXYMETHYL-AMINO}-ACETIC ACID	A	1NNF	0.7
EDT	{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]- CARBOXYMETHYL-AMINO}-ACETIC ACID	A,B	1ZLQ	0.7
NTA	NITRILOTRIACETIC ACID	A	1GVC	0.76
NTA	NITRILOTRIACETIC ACID	A	1NFT	0.76
BET	TRIMETHYL GLYCINE	A	1RCC	0.74
BET	TRIMETHYL GLYCINE	A,B	3DSB	0.74
BET	TRIMETHYL GLYCINE	A	1RCI	0.74
BET	TRIMETHYL GLYCINE	A	1SW2	0.74
BET	TRIMETHYL GLYCINE	A	1RCE	0.74
BET	TRIMETHYL GLYCINE	A	1R9L	0.74
BET	TRIMETHYL GLYCINE	A	1RCD	0.74
BET	TRIMETHYL GLYCINE	A,B,C	2WIT	0.74
BET	TRIMETHYL GLYCINE	A	2B4L	0.74
BET	TRIMETHYL GLYCINE	A	1RCG	0.74
BET	TRIMETHYL GLYCINE	A,B,C,D	1WWJ	0.74
DMG	N,N-DIMETHYLGLYCINE	A,B,C,D	1VRQ	0.74
DMG	N,N-DIMETHYLGLYCINE	A,B,C,D	1X31	0.74
DMG	N,N-DIMETHYLGLYCINE	A,B,C	1XKP	0.74
DMG	N,N-DIMETHYLGLYCINE	A,B	1EL5	0.74
LAL	N,N-DIMETHYL-L-ALANINE	A,B	1R1G	0.77
DO3	10-((2R)-2-HYDROXYPROPYL)-1,4,7,10- TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID	A	1H87	0.73
DO3	10-((2R)-2-HYDROXYPROPYL)-1,4,7,10- TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID	A,B,C,D,E,F, G,H	2QMI	0.73
BCN	BICINE	A,B,C,D	2V8H	0.83
BCN	BICINE	A	1QUS	0.83
BCN	BICINE	A	1LTM	0.83
BCN	BICINE	A	2JC5	0.83
BCN	BICINE	A,B,C,D	1V0J	0.83
BCN	BICINE	A	1QDR	0.83
BCN	BICINE	A	1KI0	0.83
BCN	BICINE	Y,Z	1KMI	0.83
BCN	BICINE	A,B,C	2OV5	0.83
BCN	BICINE	A	2A81	0.83
BCN	BICINE	A,B,C,D	2V8G	0.83
BCN	BICINE	A,B	3HWR	0.83
BCN	BICINE	A	2R6S	0.83
BCN	BICINE	A,B	2R4J	0.83