MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00815565

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
NPB	3-NITROPHENYLBORONIC ACID	A,B	1KDS	0.74
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.72
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.72
NBE	NITROSOBENZENE	A	1LH7	0.71
NBE	NITROSOBENZENE	A	2LH7	0.71
NBE	NITROSOBENZENE	A	2NSS	0.71
HFT	HYDROXYFLUTAMIDE	A	2AX6	0.72
1AN	2-FLUOROANILINE	A	1LGW	0.72
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.7
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.7
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.7
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.73
NIT	4-NITROANILINE	C,D	1RMH	0.81
NIT	4-NITROANILINE	A,B,D,F,G,H,I	2IXP	0.81
NIT	4-NITROANILINE	B	1VBS	0.81
NIT	4-NITROANILINE	C	1V9T	0.81
NIT	4-NITROANILINE	C,D	1VBT	0.81
NIT	4-NITROANILINE	B	1LOP	0.81
NIT	4-NITROANILINE	C,D	1ZKF	0.81
NIT	4-NITROANILINE	B	1PIP	0.81
MNQ	M-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D0X	0.73
1MR	N-METHYLANILINE	X	2OTZ	0.72
PNQ	P-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D0Z	0.76
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.72
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.72
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.72
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.72
DAE	O,P-DINITROPHENYL AMINOETHYLDIPHOSPHATE- BERYLLIUM TRIFLUORIDE	A	1D1A	0.71
DAQ	O,P-DINITROPHENYL AMINOPROPYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D1B	0.72
5AN	3,5-DIFLUOROANILINE	A	1LGX	0.72
ONP	O-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D0Y	0.72
NBZ	NITROBENZENE	A,B	2BMQ	0.76
NBZ	NITROBENZENE	A,B	3BGU	0.76
NIN	DINITROPHENYLENE	A	1RSM	0.74
NIN	DINITROPHENYLENE	A	1GVY	0.74
NIN	DINITROPHENYLENE	A	1GW1	0.74
NP2	N-(3-AMINOPROPYL)-2-NITROBENZENAMINE	A	1WUM	0.8
BSU	1,3-DIPHENYLUREA	A	3E85	0.75
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.75
NYL	N-ALLYL-ANILINE	A	1OVK	0.74
264	(phenylamino)acetonitrile	A	2RBN	0.74
PND	P-NITROPHENYLHYDRAZINE	A,G	1JMZ	0.75
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.74