MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00137464

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
4PP		C,L	1XKA	0.71
4PP		A,B,C,D	1XKB	0.71
MIL	MILRINONE	A,B	1TLM	0.7
368	(1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE	A	1ZLR	0.7
TPV	N-(3-{(1R)-1-[(6R)-4-HYDROXY-2- OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO- 2H-PYRAN-3-YL]PROPYL}PHENYL)-5- (TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE	A,B	2O4P	0.73
TPV	N-(3-{(1R)-1-[(6R)-4-HYDROXY-2- OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO- 2H-PYRAN-3-YL]PROPYL}PHENYL)-5- (TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE	A	1D4S	0.73
TPV	N-(3-{(1R)-1-[(6R)-4-HYDROXY-2- OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO- 2H-PYRAN-3-YL]PROPYL}PHENYL)-5- (TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE	A,B	2O4L	0.73
TPV	N-(3-{(1R)-1-[(6R)-4-HYDROXY-2- OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO- 2H-PYRAN-3-YL]PROPYL}PHENYL)-5- (TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE	A	1D4Y	0.73
TPV	N-(3-{(1R)-1-[(6R)-4-HYDROXY-2- OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO- 2H-PYRAN-3-YL]PROPYL}PHENYL)-5- (TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE	A,B	2O4N	0.73
NIO	NICOTINIC ACID	A	1JHQ	0.7
NIO	NICOTINIC ACID	A	1L5L	0.7
NIO	NICOTINIC ACID	A	2F7F	0.7
NIO	NICOTINIC ACID	A	1L5K	0.7
NIO	NICOTINIC ACID	A	1JHY	0.7
NIO	NICOTINIC ACID	A,B	1FSL	0.7
NIO	NICOTINIC ACID	A	1L5M	0.7
NIO	NICOTINIC ACID	A	1LH6	0.7
NIO	NICOTINIC ACID	A	1JHO	0.7
NIO	NICOTINIC ACID	A	3CI8	0.7
NIO	NICOTINIC ACID	A,B,C,D	1ICU	0.7
NIO	NICOTINIC ACID	A,B,C,D,E,F, G,H	3HRD	0.7
NIO	NICOTINIC ACID	A	1JHA	0.7
NIO	NICOTINIC ACID	A	1JHV	0.7
NIO	NICOTINIC ACID	A	1L4N	0.7
NIO	NICOTINIC ACID	A	2LH6	0.7
NIO	NICOTINIC ACID	A	1D0V	0.7
NIO	NICOTINIC ACID	A,B,C,D	1ICV	0.7
NIO	NICOTINIC ACID	A,B	1ICR	0.7
NIO	NICOTINIC ACID	A	1JHR	0.7
P10	[1-(3-HYDROXY-2-OXO-1-PHENETHYL- PROPYLCARBAMOYL)2-PHENYL-ETHYL]- CARBAMIC ACID PYRIDIN-4-YLMETHYL ESTER	A	1ME3	0.72
PAA	(N-METHYLPYRIDYL)ACETIC ACID	I	1HBT	0.72
PRR	3-(METHYL-PYRIDINIUM)ALANINE	H,I,J	7KME	0.77
INP	4-[[N-[(PHENYLMETHOXY)CARBONYL]- /NL/N-LEUCYL]AMINO]-1[(2S)-2-[[[4- (PYRIDINYLMETHOXY)CARBONYL]AMINO]- 4-METHYLPENT/NYL]-3-PYRROLIDINONE/N	A	1AU4	0.72
BP5	3-(2,2'-BIPYRIDIN-5-YL)-L-ALANINE	A	2PXH	0.73
GPI	(2S)-[3-PYRIDYL-1-PROPYL]-1-[3,3- DIMETHYL-1,2-DIOXOPENTYL]-2-PYRROLIDINECARBOXYLATE	A	1F40	0.73
FXV	METHYL-3-(4'-N-OXOPYRIDYLPHENOYL)- 3-METHYL-2-(M-AMIDINOBENZYL)-PROPIONATE	A	1KSN	0.71