MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01744010

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
238		A	2PRH	0.76
772	2-CYANOQUINOLIN-8-YL DIHYDROGEN PHOSPHATE	A	1O4H	0.74
BRE	2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID	A	1D3G	0.8
QNO	2-NONYL-4-HYDROXYQUINOLINE N-OXIDE	C,D,E	1NU1	0.79
QNO	2-NONYL-4-HYDROXYQUINOLINE N-OXIDE	A,B,C,D,G	2E75	0.79
DK1	5,7-DICHLORO-4-HYDROXYQUINOLINE- 2-CARBOXYLIC ACID	A,B	1PBQ	0.72
QNC	2-CARBONYLQUINOLINE	A,B	1MTB	0.74
QNC	2-CARBONYLQUINOLINE	A,B	2FGV	0.74
QNC	2-CARBONYLQUINOLINE	I	1IVQ	0.74
QNC	2-CARBONYLQUINOLINE	A,B	2FGU	0.74
QNC	2-CARBONYLQUINOLINE	A	1JLD	0.74
QNC	2-CARBONYLQUINOLINE	A,B	1HXB	0.74
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE	A,B,C	1KQG	0.79
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE	A,B,C,D,E,F	2VR0	0.79
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE	A,B,C,M,N,O,P	1KF6	0.79
PYA	3-(1,10-PHENANTHROL-2-YL)-L-ALANINE	A	1HCW	0.71
9AC	9-ACRIDINECARBONYL	A,B,G,J,K,L,M	1G3X	0.76
115	7-[3-(4-FLUORO-PHENYL)-1-ISOPROPYL- 1H-INDOL-2-YL]-3,5-DIHYDROXY-HEPTANOIC ACID	A,B,C,D	1HWI	0.71
DPY		A,B	1JES	0.71
1IQ	2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID	A	1Z8N	0.71
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CQ1	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1OTW	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1C9U	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1W6S	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1FLG	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A	1KV9	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD6	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CRU	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1H4I	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD7	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD8	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,D,I	2D0V	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	4AAH	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C,E,G	1H4J	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A	1KB0	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A	1YIQ	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1LRW	0.7
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1G72	0.7
116	7-[4-(4-FLUORO-PHENYL)-5-HYDROXYMETHYL- 2,6-DIISOPROPYL-PYRIDIN-3-YL]-3,5- DIHYDROXY-HEPTANOIC ACID	A,B,C,D	1HWJ	0.76
BRF		A	1UUO	0.8
MTK	MONTELUKAST	A	2NNI	0.71
HQU	3-HYDROXYQUINALDIC ACID	C,D	193D	0.8
IMQ	(2R,3R,4S)-2-(hydroxymethyl)-1- (quinolin-8-ylmethyl)pyrrolidine- 3,4-diol	A,B	3EPX	0.72
HTR	BETA-HYDROXYTRYPTOPHANE	A,B	1QPA	0.72
HTR	BETA-HYDROXYTRYPTOPHANE	A,B	1B80	0.72
HTR	BETA-HYDROXYTRYPTOPHANE	A	1ROV	0.72
QND	QUINALDIC ACID	A,B	1IDA	0.85
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PC2	0.73
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B,C,D	1ARZ	0.73
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PE7	0.73
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PES	0.73
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1C3V	0.73
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1P9L	0.73
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
HQA	3-(8-hydroxyquinolin-3-yl)-L-alanine	A,B	3FCA	0.74
IDA	(2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO- INDOL-7-YL)ACETIC ACID	A,B	1OXL	0.7
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid	A,B	2QYN	0.7
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid	A,B	2QYK	0.7
NPV	4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid	A	2QYL	0.7
FBQ	1-[3-({[(4-AMINO-5-FLUORO-2-METHYLQUINOLIN- 3-YL)METHYL]THIO}METHYL)PHENYL]- 2,2,2-TRIFLUOROETHANE-1,1-DIOL	A	1HBJ	0.73
9HP	9-(4-HYDROXYPHENYL)-2,7-PHENANTHROLINE	A	1PMU	0.71