MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00453684

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
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A,B,C,D	1W6F	0.74
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2V2E	0.74
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	X	2VCF	0.74
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2VCS	0.74
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A	2VCN	0.74
ISZ	4-(DIAZENYLCARBONYL)PYRIDINE	A,B	1XR3	0.74
PY7	PYRIDIN-4-YLMETHANOL	A	2EUR	0.72
K27	4-carbamoyl-1-(3-{4-[(E)-(hydroxyimino)methyl]pyridinium- 1-yl}propyl)pyridinium	A,B	2WHR	0.7
ISQ	ISOQUINOLINE	A	1GDK	0.71
NIO	NICOTINIC ACID	A	1JHQ	0.75
NIO	NICOTINIC ACID	A	1L5L	0.75
NIO	NICOTINIC ACID	A	2F7F	0.75
NIO	NICOTINIC ACID	A	1L5K	0.75
NIO	NICOTINIC ACID	A	1JHY	0.75
NIO	NICOTINIC ACID	A,B	1FSL	0.75
NIO	NICOTINIC ACID	A	1L5M	0.75
NIO	NICOTINIC ACID	A	1LH6	0.75
NIO	NICOTINIC ACID	A	1JHO	0.75
NIO	NICOTINIC ACID	A	3CI8	0.75
NIO	NICOTINIC ACID	A,B,C,D	1ICU	0.75
NIO	NICOTINIC ACID	A,B,C,D,E,F, G,H	3HRD	0.75
NIO	NICOTINIC ACID	A	1JHA	0.75
NIO	NICOTINIC ACID	A	1JHV	0.75
NIO	NICOTINIC ACID	A	1L4N	0.75
NIO	NICOTINIC ACID	A	2LH6	0.75
NIO	NICOTINIC ACID	A	1D0V	0.75
NIO	NICOTINIC ACID	A,B,C,D	1ICV	0.75
NIO	NICOTINIC ACID	A,B	1ICR	0.75
NIO	NICOTINIC ACID	A	1JHR	0.75
NA3	(3S)-3-{[(5-BROMOPYRIDIN-3-YL)CARBONYL]AMINO}- 4-OXOBUTANOIC ACID	A	1RE1	0.74
NCA	NICOTINAMIDE	A,B	2E5D	0.74
NCA	NICOTINAMIDE	A,B,C,D	2Z77	0.74
NCA	NICOTINAMIDE	A,B	1DMA	0.74
NCA	NICOTINAMIDE	A,B	1ISM	0.74
NCA	NICOTINAMIDE	A,B	1YC5	0.74
NCA	NICOTINAMIDE	A	2ZB7	0.74
NCA	NICOTINAMIDE	A,B,C,D,E,F, G,H	1R15	0.74
NCA	NICOTINAMIDE	A,B	2QQG	0.74
NCA	NICOTINAMIDE	A	2OTV	0.74
NCA	NICOTINAMIDE	A	2QHF	0.74
NCA	NICOTINAMIDE	A,B,C,D	2C8A	0.74
NCA	NICOTINAMIDE	A,B	2HJH	0.74
NCA	NICOTINAMIDE	A	2A15	0.74
NCA	NICOTINAMIDE	A	2R6V	0.74
NCA	NICOTINAMIDE	A,B	1ISI	0.74
NCA	NICOTINAMIDE	A,D,E	2R9J	0.74
NCA	NICOTINAMIDE	A	2H4J	0.74
NCA	NICOTINAMIDE	A,B	2OD9	0.74
NCA	NICOTINAMIDE	A,B,C,D,E	1YC2	0.74
NCA	NICOTINAMIDE	A,B	3DZG	0.74
NCA	NICOTINAMIDE	A	1OJU	0.74
MIL	MILRINONE	A,B	1TLM	0.7
PYF	3-PYRIDINYLCARBINOL	A,B	1R16	0.72
PY2	3-(MERCAPTOMETHYLENE)PYRIDINE	A,B	1IDA	0.74
3MP	3-METHYLPYRIDINE	A	1EUB	0.77
3MP	3-METHYLPYRIDINE	A	1BM6	0.77
NTN	ISONICOTINAMIDINE	A	7ADH	0.72
OBI	1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME	A,B	2GYW	0.71
SX2	4-[(5-bromopyridin-2-yl)amino]- 4-oxobutanoic acid	A,B	3CJ0	0.7
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T	1UW6	0.7
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P2Y	0.7
NCT	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	A	1P7R	0.7
PAA	(N-METHYLPYRIDYL)ACETIC ACID	I	1HBT	0.73
BRT	5-BROMONICOTINAMIDE	A,B	1GXZ	0.81
PBO	1-PYRIDIN-3-YLBUTAN-1-ONE	A	1PYJ	0.73