MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03481883

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
CE1	O-DODECANYL OCTAETHYLENE GLYCOL	A,B	2B7O	0.74
CE1	O-DODECANYL OCTAETHYLENE GLYCOL	A,B,D,M,N,O,P	1L0V	0.74
CE1	O-DODECANYL OCTAETHYLENE GLYCOL	A,B,D,M,N,O,P	1KFY	0.74
CE1	O-DODECANYL OCTAETHYLENE GLYCOL	A,B,C,D	2W1A	0.74
CE1	O-DODECANYL OCTAETHYLENE GLYCOL	A,B,C,M,N,O,P	1KF6	0.74
CE9	DODECYL NONA ETHYLENE GLYCOL ETHER	A	3DM8	0.74
CXE	PENTAETHYLENE GLYCOL MONODECYL ETHER	A,B	2ERV	0.76
CXE	PENTAETHYLENE GLYCOL MONODECYL ETHER	X	1UYN	0.76
CXE	PENTAETHYLENE GLYCOL MONODECYL ETHER	A	1P4T	0.76
CXE	PENTAETHYLENE GLYCOL MONODECYL ETHER	X	1UYO	0.76
CXE	PENTAETHYLENE GLYCOL MONODECYL ETHER	A,B	3FID	0.76
PH1	1,2-[DI-2,6,10,14-TETRAMETHYL-HEXADECAN- 16-OXY]-PROPANE	A	1QHJ	0.78
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B,C	2W6U	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B,C	2W16	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B,C	2W76	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B,C	2W78	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B,C,D	1WDK	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B,C	2W6T	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B	2W75	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A	1TV5	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B	2O5P	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B,C,D	1WDL	0.76
N8E	3,6,9,12,15-PENTAOXATRICOSAN-1- OL	A,B,C	2W77	0.76
DFD	DECYL FORMATE	A,B	2QNY	0.72
DFD	DECYL FORMATE	A,B	2QNZ	0.72
C10	HEXAETHYLENE GLYCOL MONODECYL ETHER	A,B	2BHI	0.76
UDT	O-DECYL HYDROGEN THIOCARBONATE	A,B	2QNX	0.7
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	2R8A	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	2VQI	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	2POR	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1H35	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	2F1T	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,D,E	2GR7	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	5PRN	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	2QTK	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1PRN	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1HXT	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1GFP	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1NQG	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	7PRN	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	X	3DWO	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1H39	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	2BIX	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1H3B	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1O6H	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1QJP	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	2ODJ	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1GFO	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	3BRY	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	3BRZ	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1GFQ	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	2ZFG	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1BXW	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1GFN	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	2O4V	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,C	1ETH	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1O6Q	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	X	2F1C	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1BH3	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1O79	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	3DZM	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	2SQC	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	8PRN	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1O6R	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	2PRN	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	3BS0	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1QJ8	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1H3A	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1MPF	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1NQH	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1GSZ	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1NQE	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1HXX	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1H37	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	1T16	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1GFM	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B	1GZM	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	3PRN	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	2OMF	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1UMP	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1H36	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A,B,C	1H3C	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	3C9L	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	6PRN	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	1NQF	0.76
C8E	(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE	A	3POR	0.76
HND	(4S)-nonane-1,4-diol	A	2KAR	0.75
HND	(4S)-nonane-1,4-diol	A	2KAS	0.75
GVT	3,6,9,12,15,18,21,24,27-nonaoxaheptatriacontan- 1-ol	A,B,C,D,E,F, G,H,I	2VQG	0.74
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2HH1	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UWT	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UXK	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	1RZH	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2HG3	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UX3	0.7
HTO	HEPTANE-1,2,3-TRIOL	A	2PIL	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B	1U19	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2J8D	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B,C,D	3DTU	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UX4	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B	1HZX	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B	2G87	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B	2PED	0.7
HTO	HEPTANE-1,2,3-TRIOL	C,H,L,M	3D38	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UWV	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	1RG5	0.7
HTO	HEPTANE-1,2,3-TRIOL	A	1KMO	0.7
HTO	HEPTANE-1,2,3-TRIOL	C,H,L,M	1L9B	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UWU	0.7
HTO	HEPTANE-1,2,3-TRIOL	A	1AY2	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B	1RP0	0.7
HTO	HEPTANE-1,2,3-TRIOL	C,H,L,M	2I5N	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2J8C	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2HJ6	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UXJ	0.7
HTO	HEPTANE-1,2,3-TRIOL	L,M	1YF6	0.7
HTO	HEPTANE-1,2,3-TRIOL	B	2BF3	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B	2HPY	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UX5	0.7
HTO	HEPTANE-1,2,3-TRIOL	L,M,X	2UXM	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UXL	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B	1L9H	0.7
HTO	HEPTANE-1,2,3-TRIOL	A	2HI2	0.7
HTO	HEPTANE-1,2,3-TRIOL	A,B,D,E,G,H, J,K	1LGH	0.7
HTO	HEPTANE-1,2,3-TRIOL	H,L,M	2UWW	0.7
PQE	3,6,12,15,18,21,24-HEPTAOXAHEXATRIACONTAN- 1-OL	A	2NR9	0.71