MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03246845

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
B70	tripotassium (1R)-4-biphenyl-4- yl-1-phosphonatobutane-1-sulfonate	A	2ZCS	0.74
I4B	ISOBUTYLBENZENE	A	184L	0.77
PXY	PARA-XYLENE	A	187L	0.75
PXY	PARA-XYLENE	A	225L	0.75
DEN	INDENE	A	183L	0.72
FEP	[(4-{4-[4-(DIFLUORO-PHOSPHONO-METHYL)- PHENYL]-BUTYL}-PHENYL)-DIFLUORO- METHYL]-PHOSPHONIC ACID	A	1KAV	0.76
FPR	PROPYLBENZENE	C	1RHK	0.77
MBN	TOLUENE	A,B	3D7O	0.74
MBN	TOLUENE	A,B	1R1X	0.74
MBN	TOLUENE	A,B	1JLX	0.74
MBN	TOLUENE	A,B,C,D	3D17	0.74
MBN	TOLUENE	A,B	2VRL	0.74
MBN	TOLUENE	A,I	2Z3E	0.74
MBN	TOLUENE	A,B	1YZI	0.74
MBN	TOLUENE	A,B	2DN1	0.74
MBN	TOLUENE	A,B	3EN1	0.74
OXE	ORTHO-XYLENE	A,B	3E0X	0.77
OXE	ORTHO-XYLENE	A	188L	0.77
2HS	HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS2	0.84
2HR	HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS1	0.84
B69		A	2ZCR	0.75
PMI	(2-AMINO-2,3-DIHYDRO-1H-INDEN-2- YL)PHOSPHONIC ACID	A,B,C,D,E,F, G,H	2O7E	0.72
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.77
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE- 1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2P1C	0.72
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE- 1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2Z7H	0.72
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.73
B08		A,B	2E99	0.71
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.73
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.73
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.73
FNP	{[7-(DIFLUORO-PHOSPHONO-METHYL)- NAPHTHALEN-2-YL]-DIFLUORO-METHYL}- PHOSPHONIC ACID	A	1KAK	0.72
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOJ	0.71
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOL	0.71
N4B	N-BUTYLBENZENE	A	186L	0.77
B28		A,B	2E9A	0.71
PYL	PHENYLETHANE	C	1B07	0.77
PYL	PHENYLETHANE	A,B	2VRM	0.77
PYL	PHENYLETHANE	A	1NHB	0.77
BDB		A,B	1KE3	0.76
787	(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACID	A	1O4R	0.8
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1DPM	0.88
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1P6B	0.88
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1PSC	0.88
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	3E3H	0.88
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1QW7	0.88
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1P6C	0.88
ARL	7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA- 2,4,6-TRIENOIC ACID	A	1NQ7	0.72