MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01071221

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
HM5	3-[(2,2-DIMETHYLPROPANOYL)AMINO]- N-1,3-THIAZOL-2-YLPYRIDINE-2-CARBOXAMIDE	A	2NQ7	0.72
C53	2-IMINO-5-(1-PYRIDIN-2-YL-METH- (E)-YLIDENE)-1,3-THIAZOLIDIN-4- ONE	A	2V0D	0.7
AJI	3-[(4-fluorophenyl)sulfanyl]-N- (4-methyl-1,3-thiazol-2-yl)-6-[(4- methyl-4H-1,2,4-triazol-3-yl)sulfanyl]pyridine- 2-carboxamide	X	3A0I	0.77
AIK	N-[3-(DIMETHYLAMINO)PROPYL]-2-({[4- ({[4-(FORMYLAMINO)-1-METHYL-1H- PYRROL-2-YL]CARBONYL}AMINO)-1-METHYL- 1H-PYRROL-2-YL]CARBONYL}AMINO)- 5-ISOPROPYL-1,3-THIAZOLE-4-CARBOXAMIDE	A,B	1RMX	0.75
9DG	9-DEAZAGUANINE	A,B,C,D,E	1Q2S	0.71
9DG	9-DEAZAGUANINE	A	1IL4	0.71
9DG	9-DEAZAGUANINE	A,C	1FSG	0.71
9DG	9-DEAZAGUANINE	A,B,C,D	1Q2R	0.71
I19	N-(4-{[(3S)-3-(dimethylamino)pyrrolidin- 1-yl]carbonyl}phenyl)-5-fluoro- 4-[2-methyl-1-(1-methylethyl)-1H- imidazol-5-yl]pyrimidin-2-amine	A	2W17	0.73
IIP	IMIDAZOLE-PYRROLE POLYAMIDE	A,B	365D	0.75
163	(2-{2-[(5-CARBAMIMIDOYL-1-METHYL- 1H-PYRROL-2-YLMETHYL)-CARBAMOYL]- PYRROL-1-YL}- 1-CYCLOHEXYLMETHYL- 2-OXO-ETHYLAMINO)-ACETIC ACID	D,H	1O0D	0.72
DMY	DISTAMYCIN A	A	217D	0.75
DMY	DISTAMYCIN A	A	1K2Z	0.75
DMY	DISTAMYCIN A	A,B,E,F	2JT7	0.75
DMY	DISTAMYCIN A	A,B	267D	0.75
DMY	DISTAMYCIN A	A	306D	0.75
DMY	DISTAMYCIN A	A	304D	0.75
DMY	DISTAMYCIN A	A	305D	0.75
DMY	DISTAMYCIN A	A	1JUX	0.75
DMY	DISTAMYCIN A	A	2DND	0.75
DMY	DISTAMYCIN A	A,B,C,D	378D	0.75
DMY	DISTAMYCIN A	B	1JTL	0.75
DMY	DISTAMYCIN A	A	159D	0.75
DMY	DISTAMYCIN A	A	216D	0.75
NIL	Nilotinib	A,B,C,D	3CS9	0.7
NIL	Nilotinib	A	3GP0	0.7
19A	N,N-DIMETHYL-4-(4-PHENYL-1H-PYRAZOL- 3-YL)-1H-PYRROLE-2-CARBOXAMIDE	A	2OJG	0.71
DBQ	DEBROMOHYMENIALDISINE	A	2C3J	0.71
DBQ	DEBROMOHYMENIALDISINE	A,B	1U4D	0.71
DBQ	DEBROMOHYMENIALDISINE	A	2CN8	0.71
DBQ	DEBROMOHYMENIALDISINE	A	1Z57	0.71
HP1	IMIDAZOLE-PYRROLE-HYDROXYPYRROLE POLYAMIDE	A,B	407D	0.74
P11	IMIDAZOLE-PYRROLE-BETA ALANINE- IMIDAZOLE-BETA ALANINE-IMIDAZOLE- PYRROLE-BETA ALANINE-DIMETHYLAMINO PROPYLAMIDE	A	1LEJ	0.73
187	1-{3-[AMINO(IMINO)METHYL]PHENYL}- N-[4-(1H-BENZIMIDAZOL-1-YL)-2-FLUOROPHENYL]- 3-(TRIFLUOROMETHYL)-1H-PYRAZOLE- 5-CARBOXAMIDE	C	1X7A	0.72
IPY	IMIDAZOLE-PYRROLE POLYAMIDE	A,B	408D	0.75
IPY	IMIDAZOLE-PYRROLE POLYAMIDE	A,B	1CVY	0.75
ILT	MONOIMIDAZOLE LEXITROPSIN	A	1LEY	0.75
ILT	MONOIMIDAZOLE LEXITROPSIN	B	1LEX	0.75
162	(2-{2-[(5-CARBAMIMIDOYL-1-METHYL- 1H-PYRROL-3-YLMETHYL)-CARBAMOYL]- PYRROL-1-YL} -1-CYCLOHEXYLMETHYL- 2-OXO-ETHYLAMINO)-ACETIC ACID	D,H	1NZQ	0.71
CYE		B	1PQQ	0.71