MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03304229

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
EDR	EDROPHONIUM ION	A	1AX9	0.73
EDR	EDROPHONIUM ION	A	2ACK	0.73
CLK	ALPHA-N-DICHLOROACETYL-P-AMINOPHENYLSERINOL	A	1GRQ	0.75
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL	A,B,C,D	1PX0	0.74
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL	A,B,C,D	2ZHM	0.74
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL	A	2ZHN	0.74
CBL	CHLORAMBUCIL	A,B	3CSJ	0.74
CLM	CHLORAMPHENICOL	A	1K01	0.7
CLM	CHLORAMPHENICOL	1,2,4,A,B,C, D,E,J,K,L,M, N,O,P,R,S,T, U,V,Z	1NJI	0.7
CLM	CHLORAMPHENICOL	A,B,C,D,E,F	2JKL	0.7
CLM	CHLORAMPHENICOL	A	2XAT	0.7
CLM	CHLORAMPHENICOL	A	4CLA	0.7
CLM	CHLORAMPHENICOL	A	1CLA	0.7
CLM	CHLORAMPHENICOL	A,B,C,D,E,F	1USQ	0.7
CLM	CHLORAMPHENICOL	A,B,C,D,E,F	2JKJ	0.7
CLM	CHLORAMPHENICOL	A,B	2UXP	0.7
CLM	CHLORAMPHENICOL	A	1QHS	0.7
CLM	CHLORAMPHENICOL	A	1QHY	0.7
CLM	CHLORAMPHENICOL	A	3CLA	0.7
MRE	2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID	A,B	2V9C	0.7
LI6	3,4-DIHYDROXY-1-METHYLQUINOLIN- 2(1H)-ONE	A	1YXV	0.72
444	N-(2,2,2-TRIFLUOROETHYL)-N-{4-[2,2,2- TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL]PHENYL}BENZENESULFONAMIDE	A	1UPV	0.71
444	N-(2,2,2-TRIFLUOROETHYL)-N-{4-[2,2,2- TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL]PHENYL}BENZENESULFONAMIDE	A,B	2O9I	0.71
444	N-(2,2,2-TRIFLUOROETHYL)-N-{4-[2,2,2- TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL]PHENYL}BENZENESULFONAMIDE	A,B,C,D	1PQC	0.71
444	N-(2,2,2-TRIFLUOROETHYL)-N-{4-[2,2,2- TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL]PHENYL}BENZENESULFONAMIDE	A,B	1UHL	0.71
444	N-(2,2,2-TRIFLUOROETHYL)-N-{4-[2,2,2- TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL]PHENYL}BENZENESULFONAMIDE	A	1UPW	0.71
DMC	3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID	G	4GCH	0.74
1JZ	1-[4-(hydroxymethyl)phenyl]guanidine	B	3FVF	0.8
BPN	PARANITROBENZYL ALCOHOL	H,L	1YEG	0.76
44B	1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2- TRIFLUOROETHYL)AMINO]PHENYL}PROPAN- 2-OL	A,B,C,D	1PQ9	0.78
SOA	ISATOIC ANHYDRIDE	A	1BIO	0.77
TYZ	PARA ACETAMIDO BENZOIC ACID	B,C	2BNI	0.71
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5K	0.71
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5J	0.71
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A,B	2VJ1	0.78
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A	2V6N	0.78
NAF	M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE	A	1AMN	0.8
NAF	M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE	A,B	2H9Y	0.8