MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00526696

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
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.73
SRB	L-1-NAPHTHYL-2-ACETAMIDO-ETHANE BORONIC ACID	B,C	3VGC	0.72
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.73
872	(3R)-4-[(3R)-3-AMINO-4-(2,4,5-TRIFLUOROPHENYL)BUTANOYL]- 3-(2,2,2-TRIFLUOROETHYL)-1,4-DIAZEPAN- 2-ONE	A,B	2IIT	0.7
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.7
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.7
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.7
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.7
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.7
MS2	2,2-DICHLORO-1-METHANESULFINYL- 3-METHYL-CYCLOPROPANECARBOXYLIC ACID [1- (4-BROMO-PHENYL)-ETHYL]-AMIDE	A,B,C	6STD	0.71
BAC	N-(4-IODO-BENZYL)-FORMAMIDE	A,B,C,D	2WPO	0.71
V35	D-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACID	B,C	2VGC	0.74
SRD	D-1-NAPHTHYL-2-ACETAMIDO-ETHANE BORONIC ACID	B,C	4VGC	0.72
S17	methyl 4-bromo-N-[8-(hydroxyamino)- 8-oxooctanoyl]-L-phenylalaninate	A,B,C,D	2VCG	0.71
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.72
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.79
APF	1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN- 2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	B,C	1GG6	0.78
APF	1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN- 2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	G	6GCH	0.78
M25	N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE	A,B	2NMX	0.72
M25	N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE	A	2NNS	0.72
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.89
APE	(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACID	E,I	1SCN	0.72
CPU		A,B	1CR6	0.71
APL	N-(1-BENZYL-3,3,3-TRIFLUORO-2,2- DIHYDROXY-PROPYL)-ACETAMIDE	B,C	1GG6	0.76
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.71
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.71
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.71
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.71
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.71
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.71
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.71
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.71
LPF	1,1,1-TRIFLUORO-3-((N-ACETYL)-L- LEUCYLAMIDO)-4-PHENYL-BUTAN-2-ONE(N- ACETYL-L-LEUCYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	G	7GCH	0.74
V36	L-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACID	B,C	1VGC	0.74