MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02533069

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
368	(1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE	A	1ZLR	0.77
DZF	5-DEAZAFOLIC ACID	A,B	2DHF	0.71
DZF	5-DEAZAFOLIC ACID	A,B	1DYH	0.71
DZF	5-DEAZAFOLIC ACID	A,B,C,D	1CDE	0.71
G44	4-({[4-(3-METHYLBENZOYL)PYRIDIN- 2-YL]AMINO}METHYL)BENZENECARBOXIMIDAMIDE	C,D	2PKS	0.7
LG2	6-[1-(3,5,5,8,8-PENTAMETHYL-5,6,7,8- TETRAHYDRONAPHTHALEN-2-YL)CYCLOPROPYL]PYRIDINE- 3-CARBOXYLIC ACID	A,B,C,D	1H9U	0.77
NA4	4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID	A,C	1RHM	0.72
AXD	2-[4-({2-[(2S,5R)-2-(AMINOMETHYL)- 5-ETHYNYLPYRROLIDIN-1-YL]-2-OXOETHYL}AMINO)- 4-METHYLPIPERIDIN-1-YL]ISONICOTINIC ACID	B	2I03	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A,B	2QTN	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4F	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4L	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C,D	1YUM	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4M	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C,D,E,F	1QPN	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C	2B7Q	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4K	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4G	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A	1YTK	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4H	0.72
NCN	NICOTINATE MONONUCLEOTIDE	A	1L5O	0.72
D3E	N-cyclopropyl-N-(trans-4-pyridin- 3-ylcyclohexyl)-4-[(1S)-2,2,2-trifluoro- 1-hydroxy-1-methylethyl]benzamide	A,B,C,D	3D3E	0.71
BFU	1-(5-BROMO-PYRIDIN-2-YL)-3-[2-(6- FLUORO-2-HYDROXY-3-PROPIONYL-PHENYL)- CYCLOPROPYL]-UREA	A	1EET	0.7
GPI	(2S)-[3-PYRIDYL-1-PROPYL]-1-[3,3- DIMETHYL-1,2-DIOXOPENTYL]-2-PYRROLIDINECARBOXYLATE	A	1F40	0.7
BP5	3-(2,2'-BIPYRIDIN-5-YL)-L-ALANINE	A	2PXH	0.7
NFL	2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID	A	1TD7	0.84
MYT	METYRAPONE	A	1PHG	0.75
MYT	METYRAPONE	A	1W0G	0.75
3HM	5-hydroxy-6-methylpyridine-3-carboxylic acid	A,B	3GMC	0.73
24X		H,L	2EC9	0.77
859	2-({2-[(3-HYDROXYPHENYL)AMINO]PYRIMIDIN- 4-YL}AMINO)BENZAMIDE	A,B	2NO3	0.75
INO	2-HYDROXYISONICOTINIC ACID N-OXIDE	M,N,O,P,Q,R	3PCL	0.72
INO	2-HYDROXYISONICOTINIC ACID N-OXIDE	M,N,O,P,Q,R	3PCJ	0.72
6PC	PYRIDINE-2-CARBOXYLIC ACID	A	2OLN	0.71
6PC	PYRIDINE-2-CARBOXYLIC ACID	A	2OLO	0.71
D1G	N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE	A,B,C,D	2FDU	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	0.7