MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03371486

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
9AM	9-AMINO-2-DEOXY-2,3-DEHYDRO-N-ACETYL- NEURAMINIC ACID	A	1F8D	0.71
AF1	4,6-dideoxy-4-{[(1S,4S,5S,6S)-4,5,6- trihydroxy-3-(hydroxymethyl)cyclohex- 2-en-1-yl]amino}-beta-D-glucopyranose	A	1BG9	1
IAB	ISO-ACARBOSE	A	1XCX	0.91
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A	3BMW	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A	1E3Z	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A	1UH3	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A	3BC9	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A	1A47	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A	2CXG	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A,B	1V3L	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A,B	1UKS	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A	1WPC	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A,B	1UKQ	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A,B	1UKT	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A,B	1V3M	0.77
ACI	6-AMINO-4-HYDROXYMETHYL-CYCLOHEX- 4-ENE-1,2,3-TRIOL	A	1UA7	0.77
AAO	ACARBOSE DERIVED HEXASACCHARIDE	A	1XH0	0.86
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	H,J,L	1RV0	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2QWC	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2SIM	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1IVF	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1SLI	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1MS1	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1USR	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B,C,D	2CEX	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1MS0	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1W8N	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1V3D	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	2F27	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	2F29	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1W0O	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1MZ6	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B,C	1WCQ	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1NSD	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2VW1	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1E8V	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	2F25	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1Z50	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2VK6	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1MS8	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	3H73	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1EUS	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1F8B	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2HTW	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1NNB	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1Z4Z	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	2VVZ	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1N1V	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B,C	1USX	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1Z4W	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A,B	1VCU	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1N1T	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	2HTR	0.71
DAN	2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID	A	1Z4V	0.71
DAF	1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4- TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE	A	2GJP	0.93
DAF	1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4- TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE	A	1G9H	0.93
DAF	1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4- TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE	A	1BG9	0.93
DAF	1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4- TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE	A	1PPI	0.93
DAF	1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4- TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE	A	1RP9	0.93
DAF	1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4- TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE	A	1G94	0.93
DAF	1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4- TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE	A	1RPK	0.93
ACG	MODIFIED ACARBOSE PENTASACCHARIDE	A,B	1LWJ	0.88
BEU	N-[(1S,2R,5R,6R)-2-AMINO-5,6-DIHYDROXY- 4-(HYDROXYMETHYL)CYCLOHEX-3-EN- 1-YL]ACETAMIDE	A,B	2JIW	0.75
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A,B	1NAA	0.7
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A	2AXR	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	0.73
ARE	ACARBOSE DERIVED PENTASACCHARIDE	A	3BAY	0.88
ARE	ACARBOSE DERIVED PENTASACCHARIDE	A	1XH2	0.88
ARE	ACARBOSE DERIVED PENTASACCHARIDE	A	1XD0	0.88
ARE	ACARBOSE DERIVED PENTASACCHARIDE	A	3BAJ	0.88
AC1	6-METHYL-5-(4,5,6-TRIHYDROXY-3- HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)- TETRAHYDRO-PYRAN-2,3,4-TRIOL	A	1W9X	1
AC1	6-METHYL-5-(4,5,6-TRIHYDROXY-3- HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)- TETRAHYDRO-PYRAN-2,3,4-TRIOL	A	1B2Y	1
AC1	6-METHYL-5-(4,5,6-TRIHYDROXY-3- HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)- TETRAHYDRO-PYRAN-2,3,4-TRIOL	A	1HX0	1
AC1	6-METHYL-5-(4,5,6-TRIHYDROXY-3- HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)- TETRAHYDRO-PYRAN-2,3,4-TRIOL	A	1OSE	1
ACR	ACARBOSE	A	1MXD	0.91
ACR	ACARBOSE	A,B	2ZQ0	0.91
ACR	ACARBOSE	A	2F6D	0.91
ACR	ACARBOSE	A,X	2QMJ	0.91
ACR	ACARBOSE	A	2OWC	0.91
ACR	ACARBOSE	A	2OWW	0.91
ACR	ACARBOSE	A	1GAH	0.91
ACR	ACARBOSE	A,B	1K1Y	0.91
ACR	ACARBOSE	A,B	1DED	0.91
ACR	ACARBOSE	A	1ESW	0.91
ACR	ACARBOSE	A	1AGM	0.91
ACR	ACARBOSE	A	1MXG	0.91
ACR	ACARBOSE	A,B	1LF9	0.91
ACR	ACARBOSE	A,B	2ECP	0.91
ACR	ACARBOSE	A	1KXH	0.91
ACR	ACARBOSE	A	1ULV	0.91
ACR	ACARBOSE	A	3BC9	0.91
3SA	ACARBOSE DERIVED TRISACCHARIDE	A	1XCW	0.94
6SA	ACARBOSE DERIVED HEXASACCHARIDE	A	1XD1	0.86
ABC	MODIFIED ACARBOSE HEXASACCHARIDE	A	7TAA	0.86
ADH	1-AMINO-2,3-DIHYDROXY-5-HYDROXYMETHYL CYCLOHEX- 5-ENE	A	1DTU	0.74
ADH	1-AMINO-2,3-DIHYDROXY-5-HYDROXYMETHYL CYCLOHEX- 5-ENE	A	1KCK	0.74
ADH	1-AMINO-2,3-DIHYDROXY-5-HYDROXYMETHYL CYCLOHEX- 5-ENE	A	2DIJ	0.74
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	0.77
HSD	(1S,2S,3R,6R)-6-amino-4-(hydroxymethyl)cyclohex- 4-ene-1,2,3-triol	A	1UH3	0.77