MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02246789

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
PEY	PHENANTHRENE	A,B	2HML	0.82
PEY	PHENANTHRENE	A,B	2HMK	0.82
B28		A,B	2E9A	0.75
787	(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACID	A	1O4R	0.78
OXE	ORTHO-XYLENE	A,B	3E0X	0.74
OXE	ORTHO-XYLENE	A	188L	0.74
AN3	ANTHRACENE	A,B	2HMN	0.82
AN3	ANTHRACENE	A,B	2HMM	0.82
PMI	(2-AMINO-2,3-DIHYDRO-1H-INDEN-2- YL)PHOSPHONIC ACID	A,B,C,D,E,F, G,H	2O7E	0.71
FEP	[(4-{4-[4-(DIFLUORO-PHOSPHONO-METHYL)- PHENYL]-BUTYL}-PHENYL)-DIFLUORO- METHYL]-PHOSPHONIC ACID	A	1KAV	0.79
B08		A,B	2E99	0.74
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1DPM	0.77
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1P6B	0.77
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1PSC	0.77
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	3E3H	0.77
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1QW7	0.77
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1P6C	0.77
PYL	PHENYLETHANE	C	1B07	0.71
PYL	PHENYLETHANE	A,B	2VRM	0.71
PYL	PHENYLETHANE	A	1NHB	0.71
N4B	N-BUTYLBENZENE	A	186L	0.71
2HS	HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS2	0.74
2HR	HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS1	0.74
NAS	2-NAPHTHALENESULFONIC ACID	I	1QUR	0.71
NAS	2-NAPHTHALENESULFONIC ACID	E,I	1PPC	0.71
NAS	2-NAPHTHALENESULFONIC ACID	H	1ETS	0.71
PXY	PARA-XYLENE	A	187L	0.71
PXY	PARA-XYLENE	A	225L	0.71
NPY	NAPHTHALENE	A,B	1O7G	0.82
2NA	naphthalen-2-ylmethanol	A,B,C	3EE5	0.71
I4B	ISOBUTYLBENZENE	A	184L	0.71
R13	3-METHYL-7-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL) -OCTA-2,4,6-TRIENOIC ACID	A	2CBS	0.71
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.72
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.72
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.72
BDB		A,B	1KE3	0.79
KTP	(2-NAPHTHALEN-2-YL-1-NAPHTHALEN- 1-YL-2-OXO-ETHYL)-PHOSPHONIC ACID	A,B	1KYN	0.75
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.74
B69		A	2ZCR	0.78
FNP	{[7-(DIFLUORO-PHOSPHONO-METHYL)- NAPHTHALEN-2-YL]-DIFLUORO-METHYL}- PHOSPHONIC ACID	A	1KAK	0.89
FPR	PROPYLBENZENE	C	1RHK	0.71
B70	tripotassium (1R)-4-biphenyl-4- yl-1-phosphonatobutane-1-sulfonate	A	2ZCS	0.76
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.72
I59	HYDROXY(1-NAPHTHYL)METHYLPHOSPHONIC ACID	A	1O4G	0.78