MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01365241

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
156	4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID	A	1FCZ	0.77
173	BENZOYL-FORMIC ACID	A,B	1SZE	0.73
5PV	5-PHENYLVALERIC ACID	A,B	2AY9	0.7
3HB	3-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCB	0.7
3HB	3-HYDROXYBENZOIC ACID	A	2DKH	0.7
791	2-PHENYLMALONIC ACID	A	1O4P	0.7
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MRA	0.74
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MNS	0.74
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1DTN	0.74
APG	ATROLACTIC ACID (2-PHENYL-LACTIC ACID)	A	1MDR	0.74
4MA	4-METHYLBENZOIC ACID	A,H	2HRG	0.82
184	6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID	A	1FCX	0.72
3CA		A,B	2B77	0.72
564	6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID	A	1FCY	0.74
4FC		A	1YSG	0.8
26C		A,B	2F7I	0.79
3BZ	3-chlorobenzoate	X	2QVZ	0.79
3BZ	3-chlorobenzoate	X	2QVX	0.79
174	4-CHLORO-BENZOIC ACID	X	3DLP	0.79
174	4-CHLORO-BENZOIC ACID	X	1T5D	0.79
2CL	(2,6-DICHLOROPHENYL)ACETIC ACID	A	2IPW	0.73
2CL	(2,6-DICHLOROPHENYL)ACETIC ACID	A	2IS7	0.73
4CB	4-CARBOXYPHENYLBORONIC ACID	A,B	1KDW	0.77
B3I	2,3,5-TRIIODOBENZOIC ACID	A	1BKE	0.74
34Z	3,4-dichlorobenzoate	X	2QVY	0.77
34Z	3,4-dichlorobenzoate	X	2QW0	0.77
AFI	2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]- 3,4-DIHYDROXY-1(2H)-NAPHTHALENONE	A,B	1UUM	0.7