MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03927531

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
UCD	(4S,5R,6R)-6-((2R,3R,4R,5R,6R)- 3-ACETAMIDO-2,5-DIHYDROXY-6-(HYDROXYMETHYL)- TETRAHYDRO-2H-PYRAN-4-YLOXY)-4,5- DIHYDROXY-5,6-DIHYDRO-4H-PYRAN- 2-CARBOXYLIC ACID	A,B	2AHG	0.82
UCD	(4S,5R,6R)-6-((2R,3R,4R,5R,6R)- 3-ACETAMIDO-2,5-DIHYDROXY-6-(HYDROXYMETHYL)- TETRAHYDRO-2H-PYRAN-4-YLOXY)-4,5- DIHYDROXY-5,6-DIHYDRO-4H-PYRAN- 2-CARBOXYLIC ACID	A	2D8L	0.82
SLF	SULFATE-3-D-GALACTOSYL-BETA-1-1- N-STEAROYL-D-SPHINGOSINE	B,D	3BRR	0.7
SLF	SULFATE-3-D-GALACTOSYL-BETA-1-1- N-STEAROYL-D-SPHINGOSINE	A,C	1ONQ	0.7
CIS	(15Z)-N-((1S,2R,3E)-2-HYDROXY-1- {[(3-O-SULFO-BETA-D-GALACTOPYRANOSYL)OXY]METHYL}HEPTADEC- 3-ENYL)TETRACOS-15-ENAMIDE	A,C	2AKR	0.7
SFT	SULFOGALACTOCERAMIDE	A,B	2BHI	0.71
HTM	6-(3-HYDROXYPROPOXY)-5-ACETAMIDO- 5,6-DIHYDRO-4-HYDROXY-4H-PYRAN- 2-CARBOXYLIC ACID	A	2F12	0.73
4AM	4-AMINO-2-DEOXY-2,3-DEHYDRO-N-NEURAMINIC ACID	A	1F8C	0.75
4AM	4-AMINO-2-DEOXY-2,3-DEHYDRO-N-NEURAMINIC ACID	A	2QWD	0.75
DYM	6-(2,3-DIHYDROXYPROPOXY)-5-ACETAMIDO- 5,6-DIHYDRO-4-HYDROXY-4H-PYRAN- 2-CARBOXYLIC ACID	A	2F13	0.74
H1S	HEPARIN DISACCHARIDE I-S	A,B	1U4L	0.72
H1S	HEPARIN DISACCHARIDE I-S	A	2NWG	0.72
H1S	HEPARIN DISACCHARIDE I-S	A,B	2FUT	0.72
TDE	(E)-(2R,3R,4S,5R)-3,4,5-TRIHYDROXY- 2-METHOXY-8,8-DIMETHYL-NON-6-ENOIC ACID ((3S,6R)- 6-HYDROXY-2-OXO-AZEPAN-3-YL)-AMIDE	A	1QZY	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	H,J,L	1RV0	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2QWC	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2SIM	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1IVF	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1SLI	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1MS1	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1USR	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B,C,D	2CEX	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1MS0	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1W8N	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1V3D	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	2F27	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	2F29	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1W0O	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1MZ6	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B,C	1WCQ	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1NSD	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2VW1	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1E8V	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	2F25	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1Z50	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2VK6	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1MS8	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	3H73	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1EUS	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1F8B	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2HTW	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1NNB	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1Z4Z	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	2VVZ	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1N1V	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B,C	1USX	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1Z4W	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1VCU	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1N1T	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2HTR	0.77
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1Z4V	0.77
49A	4,9-AMINO-2,4-DEOXY-2,3-DEHYDRO- N-ACETYL-NEURAMINIC ACID	A	1F8E	0.74
IEM	5-ACETAMIDO-5,6-DIHYDRO-4-HYDROXY- 6-ISOBUTOXY-4H-PYRAN-2-CARBOXYLIC ACID	A	2F11	0.72
ZMR	ZANAMIVIR	A	2F0Z	0.72
ZMR	ZANAMIVIR	A	1NNC	0.72
ZMR	ZANAMIVIR	A,B	3B7E	0.72
ZMR	ZANAMIVIR	A,B	1V3E	0.72
ZMR	ZANAMIVIR	A,B	1A4G	0.72
ZMR	ZANAMIVIR	A	3CKZ	0.72
ZMR	ZANAMIVIR	A	2HTQ	0.72
ZMR	ZANAMIVIR	A,B,C,D	2CML	0.72
HS2	2-deoxy-4-O-(4-deoxy-alpha-L-threo- hex-4-enopyranuronosyl)-2-{[(1R)- 1-hydroxyethyl]amino}-alpha-D-glucopyranose	A,B,C	3E80	0.78
9AM	9-AMINO-2-DEOXY-2,3-DEHYDRO-N-ACETYL- NEURAMINIC ACID	A	1F8D	0.74
H3S	HEPARIN DISACCHARIDE III-S	A,B	1U4M	0.73