MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00643403

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
NZA	5-CHLORO-1-(4-CHLOROBENZYL)-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID	A,B	2Q5S	0.7
BRF		A	1UUO	0.73
V25	ethyl 3-[(E)-2-amino-1-cyanoethenyl]- 6,7-dichloro-1-methyl-1H-indole- 2-carboxylate	A	2VAG	0.71
669	1-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)- 1H-INDOLE-2-CARBOXYLIC ACID	A	1MZS	0.72
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	C	2JQ7	0.73
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	B	1OLN	0.73
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	A	1E9W	0.73
RXC	(1S)-1-(3-chlorophenyl)-2-oxo-2- [(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin- 5-yl)amino]ethyl acetate	A,B,C,D	3DEJ	0.7
DK1	5,7-DICHLORO-4-HYDROXYQUINOLINE- 2-CARBOXYLIC ACID	A,B	1PBQ	0.74
QND	QUINALDIC ACID	A,B	1IDA	0.76
BRE	2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID	A	1D3G	0.73
CLI	3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID	A,F	1LEV	0.71
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	1C8L	0.75
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	2AMV	0.75
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	3AMV	0.75
IMN	INDOMETHACIN	A	2BXM	0.71
IMN	INDOMETHACIN	A	3FO7	0.71
IMN	INDOMETHACIN	A,B,C,D	1Z9H	0.71
IMN	INDOMETHACIN	A	2BXQ	0.71
IMN	INDOMETHACIN	A,B,C,D	4COX	0.71
IMN	INDOMETHACIN	A	2ALT	0.71
IMN	INDOMETHACIN	A	2OTH	0.71
IMN	INDOMETHACIN	A,B	2DM6	0.71
IMN	INDOMETHACIN	A	1S2A	0.71
IMN	INDOMETHACIN	A	2ZB8	0.71
IMN	INDOMETHACIN	A	3HWZ	0.71
IMN	INDOMETHACIN	A	2BXK	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
225	FELODIPINE	A	2NNJ	0.8
CBB	1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE- 2-CARBOXYLIC ACID 3-CARBAMIMIDOYL- BENZYLESTER	B	1LPK	0.72
205	2-(2,6-DICHLOROPHENYL)-1,3-BENZOXAZOLE- 6-CARBOXYLIC ACID	A,B	2F8I	0.71
238		A	2PRH	0.77
DPY		A,B	1JES	0.72
CMF	3-CYCLOHEXYL-1-(2-MORPHOLIN-4-YL- 2-OXOETHYL)-2-PHENYL-1H-INDOLE- 6-CARBOXYLIC ACID	A	2BRK	0.7
6DE	1-(2-CHLOROPHENYL)-3,5-DIMETHYL- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER	A,B	1Y2H	0.71