MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00767576

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
HAB		A,B	1SRE	0.73
MR2	3-DIPHENOL-6-NITRO-3H-BENZO[DE]ISOCHROMEN- 1-ONE	A	1TSM	0.71
NPC	4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION	H,I,J	1A6V	0.74
NCR	2-NITRO-P-CRESOL	A,B	1AHV	0.76
NIP	4-HYDROXY-5-IODO-3-NITROPHENYLACETYL- EPSILON-AMINOCAPROIC ACID ANION	H	1A6W	0.72
TY2	3-AMINO-L-TYROSINE	A,B	2VH3	0.72
MTB		A,B	1SRF	0.73
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE	A,B	1T47	0.73
HNA	1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE	A	1M2P	0.8
AZY	3-AZIDO-L-TYROSINE	A	2YXN	0.71
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.73
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.81
C00	2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione	A	3BYX	0.72
C00	2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione	A	3BZ0	0.72
MHB		A,B	1SRG	0.74
BIA	1-(3,4,DIHYDROXY-5-NITROPHENYL)- 3-{4-[3-(TRIFLUOROMETHYL) PHENYL] PIPERAZIN- 1-YL}PROPAN-1-ONE	A	1H1D	0.72
GN8	(Z)-3-BENZYL-5-(2-HYDROXY-3-NITROBENZYLIDENE)- 2-THIOXOTHIAZOLIDIN-4-ONE	A,B,C,D,E,F	2P6F	0.72
BRS	2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6- DINITRO-PHENOL	A,B,D,M,N,O,P	1KFY	0.74
DMB		A,B	1SRI	0.76
MNY	5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONE	A	1M2R	0.72
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBC	0.71
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBF	0.71
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1SXK	0.71
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.71
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.71
DNT	2-[1-METHYLHEXYL]-4,6-DINITROPHENOL	A,B,C	1NEN	0.75
MNX	1,8-DI-HYDROXY-4-NITRO-XANTHEN- 9-ONE	A	1M2Q	0.79
NIY	META-NITRO-TYROSINE	A	2ADP	0.79
NIY	META-NITRO-TYROSINE	A	3DIV	0.79
NIY	META-NITRO-TYROSINE	A	2H5U	0.79
NIY	META-NITRO-TYROSINE	A	1K4Q	0.79
NIY	META-NITRO-TYROSINE	B,G,O,Y	1SDA	0.79
SHA	SALICYLHYDROXAMIC ACID	X	1V0H	0.71
SHA	SALICYLHYDROXAMIC ACID	A	2QPK	0.71
SHA	SALICYLHYDROXAMIC ACID	A	3FNL	0.71
SHA	SALICYLHYDROXAMIC ACID	A	3GCJ	0.71
SHA	SALICYLHYDROXAMIC ACID	A	1CK6	0.71
SCL	ACETIC ACID SALICYLOYL-AMINO-ESTER	A	1EBV	0.72
BIE	(3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE	A,B	2CL5	0.79
4A3	4-AMINO-3-HYDROXYBENZOIC ACID	A,B	2HDR	0.71