MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02749541

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
2HR	HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS1	0.7
2HS	HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS2	0.7
PPT	3-(P-TOLYL)PROPIONIC ACID	A,B	2AY4	0.7
CVB	4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID	A,B	1KE0	0.72
BFL		A,B	1Q4G	0.71
RSO	R-STYRENE OXIDE	A,B	1PWZ	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A	1OS0	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJI	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJJ	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2VS2	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	1OD1	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	E	1EPR	0.72
1NH	(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE	B	1O1S	0.7
GW5	(2E)-3-{4-[(1E)-1,2-DIPHENYLBUT- 1-ENYL]PHENYL}ACRYLIC ACID	A,B,C	1R5K	0.76
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	0.74
BGG	CARBONIC ACID MONOBENZYL ESTER	B,D	1DLK	0.72
BM6	4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID	A	1MVC	0.72
BM6	4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID	A,C,E,G	1MZN	0.72
FL2	FLURBIPROFEN METHYL ESTER	A,B	1HT5	0.74
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.71
PHQ	FORMIC ACID BENZYL ESTER	A,I	2F4O	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KJO	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2CDR	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2C1E	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	5PAD	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,F	1JXQ	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	2CNO	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,B	1CGL	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ9	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2C2K	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,I	2CNL	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KJP	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2C2M	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2AZB	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	9HVP	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1ESB	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,F	1DY8	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	1PPM	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	1GEC	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KS7	0.74
PHQ	FORMIC ACID BENZYL ESTER	C	1A8G	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KKK	0.74
PHQ	FORMIC ACID BENZYL ESTER	T,U,V,W,X,Y	1QDU	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	4TMN	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	5TMN	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KTO	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,C	1TG1	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2AZ8	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,B	2G58	0.74
PHQ	FORMIC ACID BENZYL ESTER	Q,R,S,T,U,V	1F9E	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2CJY	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,I	1E8M	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KR6	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	6TMN	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KRO	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2CNN	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2C2O	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,B	1SQZ	0.74
PHQ	FORMIC ACID BENZYL ESTER	A,B	1THE	0.74
PHQ	FORMIC ACID BENZYL ESTER	I,J	2AZC	0.74
PHQ	FORMIC ACID BENZYL ESTER	E,I	5EST	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	2CNK	0.74
PHQ	FORMIC ACID BENZYL ESTER	A	1KL6	0.74
PHQ	FORMIC ACID BENZYL ESTER	I	6PAD	0.74
PHQ	FORMIC ACID BENZYL ESTER	B,I	2C2Z	0.74
2PM	N-[2-(BENZHYDRYLOXY)ETHYL]-N,N- DIMETHYLAMINE	A,B	2AOT	0.72
NIU	6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE	A	6UPJ	0.8
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A,B	2P0M	0.75
RS7	(2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID	A	1LOX	0.75
ARL	7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA- 2,4,6-TRIENOIC ACID	A	1NQ7	0.75
L79	(S)-(2E)-3[4-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-2-NAPHTHALENYL)TETRAHYDRO- 1-BENZOFURAN-2-YL]-2-PROPENOIC ACID	A,D	1RDT	0.84
UIN	5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE	B	5UPJ	0.8
TCA	PHENYLETHYLENECARBOXYLIC ACID	A	1BE6	0.73
TCA	PHENYLETHYLENECARBOXYLIC ACID	A	1BE8	0.73
TCA	PHENYLETHYLENECARBOXYLIC ACID	A,B,C,D,E,F, G,H	2O78	0.73
OST	METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE	C,D,E	1SQQ	0.8
PFI	(6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE	A	2HAI	0.71
IBP	IBUPROFEN	A	3FKX	0.71
IBP	IBUPROFEN	A,B	2BXG	0.71
IBP	IBUPROFEN	A,B	1EQG	0.71
IBP	IBUPROFEN	A,B,C	2WD9	0.71
IBP	IBUPROFEN	A	2PWS	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.71
ELI	6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID	A,B	2GH5	0.72
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.76