MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03007352

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
4FA	4-FLUOROPHENETHYL ALCOHOL	A	1OWZ	0.76
1LP	TRANYLCYPROMINE	A,B	1OJB	0.71
SS2	(1R)-1-PHENYLETHANOL	A	1ZK0	0.71
SS2	(1R)-1-PHENYLETHANOL	A	1ZJZ	0.71
SS2	(1R)-1-PHENYLETHANOL	A	1ZJY	0.71
PXY	PARA-XYLENE	A	187L	0.72
PXY	PARA-XYLENE	A	225L	0.72
2HS	HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS2	0.72
2HR	HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS1	0.72
GW5	(2E)-3-{4-[(1E)-1,2-DIPHENYLBUT- 1-ENYL]PHENYL}ACRYLIC ACID	A,B,C	1R5K	0.71
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A,B	2P0M	0.74
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A	1LOX	0.74
2NA	naphthalen-2-ylmethanol	A,B,C	3EE5	0.73
B28		A,B	2E9A	0.7
I4B	ISOBUTYLBENZENE	A	184L	0.74
BDB		A,B	1KE3	0.78
FPR	PROPYLBENZENE	C	1RHK	0.72
PPP	3-PHENYL-1,2-PROPANDIOL	A,B	1HRN	0.74
OXE	ORTHO-XYLENE	A,B	3E0X	0.72
OXE	ORTHO-XYLENE	A	188L	0.72
12M	(2-ETHYLPHENYL)METHANOL	A,B	2F62	0.73
SS1	1-PHENYLETHANOL	H	1UM5	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
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.74
N4B	N-BUTYLBENZENE	A	186L	0.72
TBC	(9S,10R)-9-HYDROXY-7,8,9,10-TETRAHYDROBENZO[A]PYRENE	A	1N8C	0.72
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1DPM	0.71
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1P6B	0.71
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1PSC	0.71
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	3E3H	0.71
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1QW7	0.71
EBP	DIETHYL 4-METHYLBENZYLPHOSPHONATE	A,B	1P6C	0.71
PYL	PHENYLETHANE	C	1B07	0.72
PYL	PHENYLETHANE	A,B	2VRM	0.72
PYL	PHENYLETHANE	A	1NHB	0.72
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.77
PEL	2-PHENYL-ETHANOL	A,B	1I0D	0.78
PEL	2-PHENYL-ETHANOL	D,H	2I0T	0.78
PEL	2-PHENYL-ETHANOL	A,B	1HZY	0.78
PEL	2-PHENYL-ETHANOL	A,B	1I0B	0.78
PEL	2-PHENYL-ETHANOL	A	1EYW	0.78
PEL	2-PHENYL-ETHANOL	A,B	1JGM	0.78
NPY	NAPHTHALENE	A,B	1O7G	0.71
BP4	BIPHENYL-4-YL-ACETALDEHYDE	A,B,E,F,G,H	1MHW	0.74