MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00624118

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
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	B,C,D	1TYM	0.76
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	B,C,D	1TYL	0.76
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	A	2OCU	0.76
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	A,B,C,D,F	3DJI	0.76
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	A	2DPZ	0.76
NIY	META-NITRO-TYROSINE	A	2ADP	0.74
NIY	META-NITRO-TYROSINE	A	3DIV	0.74
NIY	META-NITRO-TYROSINE	A	2H5U	0.74
NIY	META-NITRO-TYROSINE	A	1K4Q	0.74
NIY	META-NITRO-TYROSINE	B,G,O,Y	1SDA	0.74
TYQ	3-AMINO-6-HYDROXY-TYROSINE	A,B	1D6Y	0.72
TYQ	3-AMINO-6-HYDROXY-TYROSINE	A,B	1D6U	0.72
NPC	4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION	H,I,J	1A6V	0.75
NIP	4-HYDROXY-5-IODO-3-NITROPHENYLACETYL- EPSILON-AMINOCAPROIC ACID ANION	H	1A6W	0.72
LI6	3,4-DIHYDROXY-1-METHYLQUINOLIN- 2(1H)-ONE	A	1YXV	0.7
790	1,2,3,4-TETRAHYDROQUINOLIN-8-YL DIHYDROGEN PHOSPHATE	A	1O4F	0.73
A48	4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL	A,B	2Q6J	0.73
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.7
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.7
2AC	2-AMINO-P-CRESOL	H,I	1A2C	0.81
2AC	2-AMINO-P-CRESOL	A	1L4M	0.81
ST2	4-(ACETYLAMINO)-5-AMINO-3-HYDROXYBENZOIC ACID	A,B	1IVC	0.71
FEN	N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE	A	1FEL	0.79
MBQ	2-HYDROXY-5-({1-[(4-METHYLPHENOXY)METHYL]- 3-OXOPROP-1-ENYL}AMINO)-L-TYROSINE	A	1SIH	0.7
EDR	EDROPHONIUM ION	A	1AX9	0.72
EDR	EDROPHONIUM ION	A	2ACK	0.72
AY1	ANTIMYCIN A1	C,D,E	1NTK	0.72
3GV	(3S)-1-(2-hydroxyphenyl)-5-oxopyrrolidine- 3-carboxylic acid	A,B	3GVB	0.72
2AF	2-AMINOPHENOL	A	1L4N	0.72
3B4	2-(cyclohexylamino)benzoic acid	A,B	3B4P	0.73
AA6	3-[4,5-DIHYDROXY-2-2-(2-HYDROXYETHYLAMINO)- PHENYL]-2-METHYLAMINO-PROPIONIC ACID	E,I	1QR3	0.72
TY2	3-AMINO-L-TYROSINE	A,B	2VH3	0.79
44B	1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2- TRIFLUOROETHYL)AMINO]PHENYL}PROPAN- 2-OL	A,B,C,D	1PQ9	0.7
NAF	M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE	A	1AMN	0.71
NAF	M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE	A,B	2H9Y	0.71
ANT	ANTHRAMYCIN	A	274D	0.71
HPF	1-[(2-HYDROXYLPHENYL)AMINO]3-GLYCEROLPHOSPHATE	A,B	1TJP	0.74
AZY	3-AZIDO-L-TYROSINE	A	2YXN	0.78
DMC	3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID	G	4GCH	0.78
NCR	2-NITRO-P-CRESOL	A,B	1AHV	0.73
4A3	4-AMINO-3-HYDROXYBENZOIC ACID	A,B	2HDR	0.71