MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00831408

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
QNC	2-CARBONYLQUINOLINE	A,B	1MTB	0.75
QNC	2-CARBONYLQUINOLINE	A,B	2FGV	0.75
QNC	2-CARBONYLQUINOLINE	I	1IVQ	0.75
QNC	2-CARBONYLQUINOLINE	A,B	2FGU	0.75
QNC	2-CARBONYLQUINOLINE	A	1JLD	0.75
QNC	2-CARBONYLQUINOLINE	A,B	1HXB	0.75
SF1	1-BENZYL-5-CHLORO-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID	A,B	2Q61	0.71
FIC	5-fluoroindole-2-carboxylic acid	A,B	3DWS	0.72
225	FELODIPINE	A	2NNJ	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CQ1	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1OTW	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1C9U	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1W6S	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1FLG	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A	1KV9	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD6	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CRU	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1H4I	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD7	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD8	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,D,I	2D0V	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C	4AAH	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C,E,G	1H4J	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A	1KB0	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A	1YIQ	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1LRW	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1G72	0.75
BRF		A	1UUO	0.78
CLI	3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID	A,F	1LEV	0.75
HQU	3-HYDROXYQUINALDIC ACID	C,D	193D	0.78
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B,C	2W2I	0.75
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A	2GKL	0.75
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B	2VD7	0.75
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B	2JIG	0.75
1IQ	2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID	A	1Z8N	0.71
NZA	5-CHLORO-1-(4-CHLOROBENZYL)-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID	A,B	2Q5S	0.71
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	1C8L	0.74
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	2AMV	0.74
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	3AMV	0.74
MTK	MONTELUKAST	A	2NNI	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PC2	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B,C,D	1ARZ	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PE7	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PES	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1C3V	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1P9L	0.75
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	C	2JQ7	0.79
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	B	1OLN	0.79
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	A	1E9W	0.79
BRE	2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID	A	1D3G	0.78
QND	QUINALDIC ACID	A,B	1IDA	0.86
DK1	5,7-DICHLORO-4-HYDROXYQUINOLINE- 2-CARBOXYLIC ACID	A,B	1PBQ	0.82
9AC	9-ACRIDINECARBONYL	A,B,G,J,K,L,M	1G3X	0.72
238		A	2PRH	0.84