MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02876099

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
HBQ	ISOPROPYL (2S)-2-ETHYL-7-FLUORO- 3-OXO-3,4-DIHYDROQUINOXALINE-1(2H)- CARBOXYLATE	A	2OPR	0.71
HBQ	ISOPROPYL (2S)-2-ETHYL-7-FLUORO- 3-OXO-3,4-DIHYDROQUINOXALINE-1(2H)- CARBOXYLATE	A,B	2OPS	0.71
HBQ	ISOPROPYL (2S)-2-ETHYL-7-FLUORO- 3-OXO-3,4-DIHYDROQUINOXALINE-1(2H)- CARBOXYLATE	A	2OPP	0.71
HBQ	ISOPROPYL (2S)-2-ETHYL-7-FLUORO- 3-OXO-3,4-DIHYDROQUINOXALINE-1(2H)- CARBOXYLATE	A	2OPQ	0.71
BL5		A,B	1RL4	0.76
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE	A	2BGE	0.75
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A,B	1EK1	0.75
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A	1VJ5	0.75
4ND	N4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINE	H,I	1NO9	0.75
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.71
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.71
BSU	1,3-DIPHENYLUREA	A	3E85	0.74
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.74
MPX	4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDE	A	1ZH9	0.71