MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02626066

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
HQU	3-HYDROXYQUINALDIC ACID	C,D	193D	0.75
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CQ1	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1OTW	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1C9U	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1W6S	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1FLG	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A	1KV9	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD6	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CRU	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1H4I	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD7	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD8	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,D,I	2D0V	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	4AAH	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C,E,G	1H4J	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A	1KB0	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A	1YIQ	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1LRW	0.74
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1G72	0.74
BRF		A	1UUO	0.73
QND	QUINALDIC ACID	A,B	1IDA	0.82
FIC	5-fluoroindole-2-carboxylic acid	A,B	3DWS	0.72
DK1	5,7-DICHLORO-4-HYDROXYQUINOLINE- 2-CARBOXYLIC ACID	A,B	1PBQ	0.85
PYA	3-(1,10-PHENANTHROL-2-YL)-L-ALANINE	A	1HCW	0.71
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
1IQ	2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID	A	1Z8N	0.71
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B,C	2W2I	0.73
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A	2GKL	0.73
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B	2VD7	0.73
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B	2JIG	0.73
NZA	5-CHLORO-1-(4-CHLOROBENZYL)-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID	A,B	2Q5S	0.71
NHR	2-{4-[2-(2-AMINO-4-HYDROXY-QUINAZOLIN- 6-YL)-1-CARBOXY-ETHYL]-BENZOYLAMINO}- PENTANEDIOIC ACID	A,B	1C3E	0.71
238		A	2PRH	0.78
BRE	2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID	A	1D3G	0.73
2CC	3,4-bis(7-chloro-1H-indol-3-yl)- 1H-pyrrole-2,5-dicarboxylic acid	A	3A1L	0.72
CLI	3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID	A,F	1LEV	0.81
UN9	N-[(1-CHLORO-4-HYDROXYISOQUINOLIN- 3-YL)CARBONYL]GLYCINE	A	2HBT	0.78
UN9	N-[(1-CHLORO-4-HYDROXYISOQUINOLIN- 3-YL)CARBONYL]GLYCINE	A	2HBU	0.78
669	1-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)- 1H-INDOLE-2-CARBOXYLIC ACID	A	1MZS	0.71
CQA	4-[(7-CHLOROQUINOLIN-4-YL)AMINO]- 2-[(DIETHYLAMINO)METHYL]PHENOL	A,B	2AOU	0.71
HQA	3-(8-hydroxyquinolin-3-yl)-L-alanine	A,B	3FCA	0.7
452	2-{[N-(2-ACETYL-5-CHLORO-4-FLUOROPHENYL)GLYCYL]AMINO}BENZOIC ACID	A,B	2QE2	0.71
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	1C8L	0.72
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	2AMV	0.72
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	3AMV	0.72
6CW	6-CHLORO-L-TRYPTOPHAN	B	2GV2	0.7
6CW	6-CHLORO-L-TRYPTOPHAN	A,B	2AXI	0.7
6CW	6-CHLORO-L-TRYPTOPHAN	A,L,M	3FEA	0.7
4HG	N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE	A	2G19	0.71
4HG	N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE	A	2G1M	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PC2	0.72
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B,C,D	1ARZ	0.72
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PE7	0.72
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PES	0.72
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1C3V	0.72
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1P9L	0.72