MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03716492

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
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7Y	0.79
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7X	0.79
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R81	0.79
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7V	0.79
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R80	0.79
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1FQ9	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	B	2AXM	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1GMN	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1T8U	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1BFB	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	B,D,F,H	1XMN	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D,E,F, G,H	1GMO	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D,E,F	1AXM	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1XT3	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	1	1QQP	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1RID	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1G5N	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	2BRS	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1HPN	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1ZA4	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	1	1ZBA	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1BFC	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D	2VRA	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A	2HYV	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	H,I	3B9F	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	3DY0	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	A	2HYU	0.72
SGN	N,O6-DISULFO-GLUCOSAMINE	B,C,D,E	1E0O	0.72
GCN	3-DEOXY-D-GLUCOSAMINE	A	1FI1	0.81
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QFG	0.81
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QKC	0.81
GCN	3-DEOXY-D-GLUCOSAMINE	A,B	2GRX	0.81
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QJQ	0.81
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QFF	0.81
2TB	1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANE	A	2TOB	0.73
GP1	GLUCOSAMINE 1-PHOSPHATE	A,B,C	1Q9W	0.72
GP1	GLUCOSAMINE 1-PHOSPHATE	A,B	2OI6	0.72
GP1	GLUCOSAMINE 1-PHOSPHATE	A	2FCP	0.72
GP1	GLUCOSAMINE 1-PHOSPHATE	A	1FCP	0.72
GP1	GLUCOSAMINE 1-PHOSPHATE	A	1UJW	0.72
GP4	GLUCOSAMINE 4-PHOSPHATE	A	1FCP	0.72
GP4	GLUCOSAMINE 4-PHOSPHATE	A,B,C	1Q9W	0.72
GP4	GLUCOSAMINE 4-PHOSPHATE	A	2FCP	0.72
MUR	MURAMIC ACID	A,C,E,G	1LOD	0.71
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1QD3	0.82
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1NEM	0.82
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1PBR	0.82
SNG	METHYL 2-ACETAMIDO-1,2-DIDEOXY- 1-SELENO-BETA-D-GLUCOPYRANOSIDE	A	2BWM	0.73
SNG	METHYL 2-ACETAMIDO-1,2-DIDEOXY- 1-SELENO-BETA-D-GLUCOPYRANOSIDE	A	1O9V	0.73
GOO	(1R,2R,3R,4S,5R)-4-amino-5-methoxycyclopentane- 1,2,3-triol	A	3DX4	0.79
GLP	GLUCOSAMINE 6-PHOSPHATE	E,F,G,H,P,Q, R,S	2NZ4	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	A	1MOQ	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	A	3CXQ	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4A	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4C	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4B	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2VHL	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2Z75	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	X	2VF5	0.72
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2RI1	0.72
YHO	(1S,2S,3R,4R)-4-aminocyclopentane- 1,2,3-triol	A	3DX1	0.75
AOG	4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R82	0.76
AOL	(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE- 1,2,3,4-TETROL	A	2F7Q	0.74
DFU	(2S,3R,4S,5R)-2-METHYLPIPERIDINE- 3,4,5-TRIOL	A,B	2EAC	0.76
TOB	1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANE	A	1TOB	0.74
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A	2JCQ	0.74
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A,B	2IH9	0.74
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A,B,C,D,E,F	2J2P	0.74
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A	3DIV	0.74
1GN	2-DEOXY-2-AMINOGALACTOSE	A,B	3GAL	0.81
CYY	2-DEOXYSTREPTAMINE	A	1QD3	0.75
TOC	2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSE	A	2TOB	0.8
TOC	2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSE	A	1TOB	0.8
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1CPU	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1NM9	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFV	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1PIG	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	1Z32	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFU	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3BLK	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	3BLP	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3DHP	0.86
GL6	(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-2-YL)-PHOSPHORAMIDIC ACID DIMETHYL ESTER	A	1XC7	0.71
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ9	0.72
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ4	0.72
GNS	N-SULFO-ALPHA-D-GLUCOSAMINE	A	2ERM	0.74
AZF	AZAFAGOMINE	A,B	2J7H	0.7
YTB	(1R,2R,3S,4R,5R)-5-aminocyclopentane- 1,2,3,4-tetrol	A	3DX3	0.74
GCS	D-GLUCOSAMINE	A	3CO4	0.81
GCS	D-GLUCOSAMINE	A	1QGI	0.81
GCS	D-GLUCOSAMINE	A,B	2VZS	0.81
GCS	D-GLUCOSAMINE	A	1E9L	0.81
GCS	D-GLUCOSAMINE	A,B,C,D	3FXI	0.81
GCS	D-GLUCOSAMINE	A,B	2VZV	0.81
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1QD3	0.82
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	B	1O9M	0.82
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1NEM	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A,B	1OIM	0.74
NOJ	1-DEOXYNOJIRIMYCIN	A,B	2J77	0.74
NOJ	1-DEOXYNOJIRIMYCIN	A,B	2JKE	0.74
NOJ	1-DEOXYNOJIRIMYCIN	A	3GBE	0.74
NOJ	1-DEOXYNOJIRIMYCIN	A,B	3GXT	0.74
NOJ	1-DEOXYNOJIRIMYCIN	A,B	1DIE	0.74
NOJ	1-DEOXYNOJIRIMYCIN	A	1DOG	0.74
NOJ	1-DEOXYNOJIRIMYCIN	A,B	1I75	0.74
NOJ	1-DEOXYNOJIRIMYCIN	A,B	2PWD	0.74
DMJ	1-DEOXYMANNOJIRIMYCIN	A,B	1KRE	0.74
DMJ	1-DEOXYMANNOJIRIMYCIN	A	1FO2	0.74
DMJ	1-DEOXYMANNOJIRIMYCIN	A	1G6I	0.74
DMJ	1-DEOXYMANNOJIRIMYCIN	A	1HXK	0.74
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A	2PIK	0.86
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A	6CGT	0.86
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A,B	1PIK	0.86
MYG	GLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOL	A	1GYM	0.72
PA1	PAROMOMYCIN (RING 1)	A	1PBR	0.81
PA1	PAROMOMYCIN (RING 1)	A	1QKC	0.81
PA1	PAROMOMYCIN (RING 1)	A	1QFG	0.81
PA1	PAROMOMYCIN (RING 1)	A	1FI1	0.81
PA1	PAROMOMYCIN (RING 1)	A,B,C,D	3FXI	0.81
PA1	PAROMOMYCIN (RING 1)	A	1QFF	0.81
NEB	2-DEOXY-D-STREPTAMINE	A	1NEM	0.75
TOA	3-DEOXY-3-AMINO GLUCOSE	A	1TOB	0.83
TOA	3-DEOXY-3-AMINO GLUCOSE	A	2TOB	0.83
GDA	4-DEOXY-4-AMINO-BETA-D-GLUCOSE	A,B	1OCB	0.85
XXX	(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)- 4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)- 5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO- 2H-PYRAN-3,4-DIOL	B	2F4S	0.7
XXX	(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)- 4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)- 5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO- 2H-PYRAN-3,4-DIOL	A,B	2FCX	0.7
XXX	(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)- 4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)- 5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO- 2H-PYRAN-3,4-DIOL	B	2ET8	0.7
OXZ	TETRAHYDROOXAZINE	A,B	1W3J	0.72
OXZ	TETRAHYDROOXAZINE	A	1W3K	0.72
OXZ	TETRAHYDROOXAZINE	A	1W3L	0.72
DT6	2,4-BIS(ACETYLAMINO)-1,5-ANHYDRO- 2,4-DIDEOXY-D-GLUCITOL	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R	2HIL	0.71
DT6	2,4-BIS(ACETYLAMINO)-1,5-ANHYDRO- 2,4-DIDEOXY-D-GLUCITOL	A	2HI2	0.71
PA2	PAROMOMYCIN (RING 2)	B	1O9M	0.75
PA2	PAROMOMYCIN (RING 2)	A	1PBR	0.75
GE1	3,4-DIDEOXY-2,6-AMINO-ALPHA-D GALACTOPYRANOSE	A	1BYJ	0.73
CGF	C-(1-AZIDO-ALPHA-D-GLUCOPYRANOSYL) FORMAMIDE	A	1P4G	0.74