MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02120328

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
3NT	3-NITROTOLUENE	A,B	2BMR	0.74
3NT	3-NITROTOLUENE	A,B	2HMO	0.74
NIT	4-NITROANILINE	C,D	1RMH	0.79
NIT	4-NITROANILINE	A,B,D,F,G,H,I	2IXP	0.79
NIT	4-NITROANILINE	B	1VBS	0.79
NIT	4-NITROANILINE	C	1V9T	0.79
NIT	4-NITROANILINE	C,D	1VBT	0.79
NIT	4-NITROANILINE	B	1LOP	0.79
NIT	4-NITROANILINE	C,D	1ZKF	0.79
NIT	4-NITROANILINE	B	1PIP	0.79
TNS		A,B,L	2G2R	0.71
NMQ	N-METHYL O-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D1C	0.76
264	(phenylamino)acetonitrile	A	2RBN	0.8
1MR	N-METHYLANILINE	X	2OTZ	0.75
NIN	DINITROPHENYLENE	A	1RSM	0.77
NIN	DINITROPHENYLENE	A	1GVY	0.77
NIN	DINITROPHENYLENE	A	1GW1	0.77
MNQ	M-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D0X	0.73
NPB	3-NITROPHENYLBORONIC ACID	A,B	1KDS	0.77
01W	(2S)-2-ammonio-4-[(2,4-dinitrophenyl)amino]butanoate	A,B	3DS9	0.71
NBZ	NITROBENZENE	A,B	2BMQ	0.79
NBZ	NITROBENZENE	A,B	3BGU	0.79
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.77
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.7
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.75
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.75
TNL	2,4,6-TRINITROTOLUENE	A	1GVR	0.7
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE	A	2BGE	0.71
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.72
NPP	N-(2-AMINO-ETHYL)-4,6-DINITRO-N'- (2,2,6,6-TETRAMETHYL-1-OXY-PIPERIDIN- 4-YL)-BENZENE-1,3-DIAMINE	L	1BAF	0.72
PNQ	P-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D0Z	0.75
NP2	N-(3-AMINOPROPYL)-2-NITROBENZENAMINE	A	1WUM	0.83
259	1-(methylsulfanyl)-4-nitrobenzene	X	2RAZ	0.71
PND	P-NITROPHENYLHYDRAZINE	A,G	1JMZ	0.73
ONP	O-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D0Y	0.71
DAE	O,P-DINITROPHENYL AMINOETHYLDIPHOSPHATE- BERYLLIUM TRIFLUORIDE	A	1D1A	0.7
DAQ	O,P-DINITROPHENYL AMINOPROPYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D1B	0.71
NYL	N-ALLYL-ANILINE	A	1OVK	0.77
171	2-PHENYLAMINO-ETHANESULFONIC ACID	A,B	1SXG	0.7
NBE	NITROSOBENZENE	A	1LH7	0.74
NBE	NITROSOBENZENE	A	2LH7	0.74
NBE	NITROSOBENZENE	A	2NSS	0.74