MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03101866

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
NCN	NICOTINATE MONONUCLEOTIDE	A,B	2QTN	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4F	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4L	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C,D	1YUM	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4M	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C,D,E,F	1QPN	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C	2B7Q	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4K	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4G	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A	1YTK	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4H	0.73
NCN	NICOTINATE MONONUCLEOTIDE	A	1L5O	0.73
MNT	2'(3')-O-N-METHYLANTHRANILOYL-ADENOSINE- 5'-DIPHOSPHATE	A	1LVK	0.75
NIO	NICOTINIC ACID	A	1JHQ	0.74
NIO	NICOTINIC ACID	A	1L5L	0.74
NIO	NICOTINIC ACID	A	2F7F	0.74
NIO	NICOTINIC ACID	A	1L5K	0.74
NIO	NICOTINIC ACID	A	1JHY	0.74
NIO	NICOTINIC ACID	A,B	1FSL	0.74
NIO	NICOTINIC ACID	A	1L5M	0.74
NIO	NICOTINIC ACID	A	1LH6	0.74
NIO	NICOTINIC ACID	A	1JHO	0.74
NIO	NICOTINIC ACID	A	3CI8	0.74
NIO	NICOTINIC ACID	A,B,C,D	1ICU	0.74
NIO	NICOTINIC ACID	A,B,C,D,E,F, G,H	3HRD	0.74
NIO	NICOTINIC ACID	A	1JHA	0.74
NIO	NICOTINIC ACID	A	1JHV	0.74
NIO	NICOTINIC ACID	A	1L4N	0.74
NIO	NICOTINIC ACID	A	2LH6	0.74
NIO	NICOTINIC ACID	A	1D0V	0.74
NIO	NICOTINIC ACID	A,B,C,D	1ICV	0.74
NIO	NICOTINIC ACID	A,B	1ICR	0.74
NIO	NICOTINIC ACID	A	1JHR	0.74
C24	3-({2-[(4-CARBAMIMIDOYL-PHENYLAMINO)- METHYL]-3-METHYL-3H-BENZOIMIDAZOLE- 5-CARBONYL}-PYRIDIN-2-YL-AMINO)- PROPIONIC ACID ETHYL ESTER	B,C	1KTS	0.73
AGN		A	1GNP	0.72
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B,C,D,E,F	1KQO	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B	2H29	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B	1NUQ	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A	1WXG	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B,C,D,E,F	1KAQ	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B	1EE1	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B,C,D	3E27	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A	1XQD	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B	2H2A	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B	1IFX	0.74
DND	NICOTINIC ACID ADENINE DINUCLEOTIDE	A,B	1XNG	0.74
627	N-[(3E)-5-[(2R)-2-METHOXY-2-PHENYLACETYL]PYRROLO[3,4- C]PYRAZOL-3(5H)-YLIDENE]-4-(4-METHYLPIPERAZIN- 1-YL)BENZAMIDE	A,B	2J50	0.7
627	N-[(3E)-5-[(2R)-2-METHOXY-2-PHENYLACETYL]PYRROLO[3,4- C]PYRAZOL-3(5H)-YLIDENE]-4-(4-METHYLPIPERAZIN- 1-YL)BENZAMIDE	A,B	2V7A	0.7
7CS	(3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT- 3-YL 1H-PYRROLO[2,3-B]PYRIDINE- 3-CARBOXYLATE	A	2QHM	0.79
R86	2-{(2R)-4-[2-(1H-IMIDAZOL-1-YL)- 6-METHYLPYRIMIDIN-4-YL]-1-ISOBUTYRYLPIPERAZIN- 2-YL}-N-[2-(4-METHOXYPHENYL)ETHYL]ACETAMIDE	A	2ORP	0.7
ONM	3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE- 5'-TRIPHOSPHATE	A,C	1TL7	0.7
ONM	3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE- 5'-TRIPHOSPHATE	A,C	1U0H	0.7
D1G	N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE	A,B,C,D	2FDU	0.71
DOT	3'ANTHRANILOYL-2'-DEOXY-ADENOSINE- 5'-TRIPHOSPHATE	A,B,C,D,E,F	1LVC	0.75
P3Y	5-[3-(2-METHOXYPHENYL)-1H-PYRROLO[2,3- B]PYRIDIN-5-YL]-N,N-DIMETHYLPYRIDINE- 3-CARBOXAMIDE	A	2Z60	0.71
P3Y	5-[3-(2-METHOXYPHENYL)-1H-PYRROLO[2,3- B]PYRIDIN-5-YL]-N,N-DIMETHYLPYRIDINE- 3-CARBOXAMIDE	A,B	2QOH	0.71
2SM	methyl 2-{[(4-methylpyrimidin-2- yl)carbamoyl]sulfamoyl}benzoate	A	3EA4	0.7
4RB	4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2- b]pyridazin-3-yl)benzoic acid	A	3BQR	0.72
NFL	2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID	A	1TD7	0.75
ONA		A,C	2GVZ	0.73
368	(1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE	A	1ZLR	0.79
2C5	2-CHLORO-5-(3-CHLORO-PHENYL)-6- [(4-CYANO-PHENYL)-(3-METHYL-3H- IMIDAZOL-4-YL)- METHOXYMETHYL]- NICOTINONITRILE	B	1NI1	0.72
NXX		A,B,C,D	3DLA	0.74
NXX		A,B,C	2QTR	0.74
688	2-[AMINO(IMINO)METHYL]-2-HYDROXYPHENOXY]- 6-[3-(4,5-DIHYDRO-1H-IMIDAZOL-2- YL)PHENOXY]PYRIDINE-4-CARBOXYLIC ACID	A	1QBN	0.7
AXD	2-[4-({2-[(2S,5R)-2-(AMINOMETHYL)- 5-ETHYNYLPYRROLIDIN-1-YL]-2-OXOETHYL}AMINO)- 4-METHYLPIPERIDIN-1-YL]ISONICOTINIC ACID	B	2I03	0.7
A3D	3-ACETYLPYRIDINE ADENINE DINUCLEOTIDE	A,B,C,D	1PZG	0.71
A3D	3-ACETYLPYRIDINE ADENINE DINUCLEOTIDE	A	1DRV	0.71
A3D	3-ACETYLPYRIDINE ADENINE DINUCLEOTIDE	A,B	2EWD	0.71
A3D	3-ACETYLPYRIDINE ADENINE DINUCLEOTIDE	A,B,C,D	1PZF	0.71
NGD		A,B	2O3U	0.7