MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00884361

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
771	4-(4-BENZYLOXY-2-METHANESULFONYLAMINO- 5-METHOXY-BENZYLAMINO)-BENZAMIDINE	H,L	1W0Y	0.71
J88	(3Z)-1-[(6-fluoro-4H-1,3-benzodioxin- 8-yl)methyl]-4-phenyl-1H-indole- 2,3-dione 3-oxime	A	3G9N	0.71
I3N	1-BENZYL-5-METHOXY-2-METHYL-1H- INDOL-3-YL)-ACETIC ACID	A	1DCY	0.73
GSG	1S,3AS,8AS-TRIMETHYL-1-OXIDO-1,2,3,3A,8,8A- HEXAHYDROPYRROLO[2,3-B]INDOL-5- YL 2-ETHYLPHENYLCARBAMATE	A	2BAG	0.71
PTI	2-PHENYL-1-[4-(2-PIPERIDIN-1-YL- ETHOXY)-PHENYL]-1,2,3,4-TETRAHYDRO- ISOQUINOLIN-6-OL	A	1UOM	0.73
L05	1-BENZYL-3-(4-METHOXYPHENYLAMINO)- 4-PHENYLPYRROLE-2,5-DIONE	A,B,C,D,E,F, G,H	2ACL	0.71
R5A	RUTHENIUM WIRE, 5 CARBON LINKER	A	2CFK	0.72
YOM	2,2'-[1,2-PHENYLENEBIS(NITRILOMETHYLIDYNE)]BIS[PHENOLATO]](2- )-N,N',O,O']-IRON	A,B	1WZG	0.7
R6A	RUTHENIUM WIRE, 6 CARBON LINKER	A	2CFL	0.72
783	3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-5-METHOXY-1,1'-BIPHENYL-2- OLATE	A	1O2T	0.72
806	7-[[2-[[1-(1-IMINOETHYL)PIPERIDIN- 4-YL]OXY]-9H-CARBOZOL-9-YL]METHYL]NAPHTHALENE- 2-CARBOXIMIDAMID	A	1QB9	0.71
R7U	RUTHENIUM WIRE, 7 CARBON LINKER	A	2CFW	0.72
J67	(3Z)-1-[(6-fluoro-4H-1,3-benzodioxin- 8-yl)methyl]-4-[(E)-2-phenylethenyl]- 1H-indole-2,3-dione 3-oxime	X	3G9L	0.71
QUM	QUINACRINE MUSTARD	A,B	1GXF	0.74
RHQ	RHODAMINE 6G	A,B,D,E	1JUS	0.7
RHQ	RHODAMINE 6G	A,B,D,E	3BR5	0.7
RHQ	RHODAMINE 6G	A,D,E	3BR6	0.7
RHQ	RHODAMINE 6G	A,B	3D6Z	0.7
RHQ	RHODAMINE 6G	A	1OY8	0.7
RHQ	RHODAMINE 6G	A	1T9V	0.7
R9A	RUTHENIUM WIRE, 9 CARBON LINKER	A	2CG0	0.72
GVB	(3R,4S)-1-(3,4-DIMETHOXYPHENYL)- 3-(3-METHYLPHENYL)PIPERIDIN-4-AMINE	A,B	2JID	0.72
SIE	SULFAMIC ACID 1-DECYL-2-(4-SULFAMOYLOXYPHENYL)- 1H-INDOL-6-YL ESTER	A	2BRP	0.7
ML2	N-[2-(2-iodo-5-methoxy-1H-indol- 3-yl)ethyl]acetamide	A,B	2QX9	0.72
ML2	N-[2-(2-iodo-5-methoxy-1H-indol- 3-yl)ethyl]acetamide	A,B	2QX8	0.72
ROS	N,N'-TETRAMETHYL-ROSAMINE	A	1F1T	0.77
ML1	N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide	A,B	2QX4	0.72
ML1	N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide	A,B	2QX6	0.72
ML1	N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide	A,B	2QWX	0.72
R5B	RUTHENIUM WIRE WC5	A	2CFK	0.72