MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00445937

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
CHQ	CYCLO-(L-HISTIDINE-L-PROLINE) INHIBITOR	A,B	1W1T	0.8
HRB	N-ACETYL-1-[(2R,3S,5R)-5-HYDROXY- 2-PENTYLTETRAHYDROFURAN-3-YL]-L- HISTIDINE	H,L	2DDQ	0.72
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	T	2P8Z	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	T	2P8Y	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A,B,C,D,E,F	2ZIT	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A,C,E	1ZM3	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A	1U2R	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A,B,C,D,E,F	1ZM9	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A,B,C,D,E,F	3B78	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A,B,C,D,E,F	3B8H	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	T	2P8X	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A,B,C,D,E,F	3B82	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A,B,C,D,E,F	1ZM4	0.78
DDE	{3-[4-(2-AMINO-2-CARBOXY-ETHYL)- 1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}- TRIMETHYL-AMMONIUM	A,C,E	1ZM2	0.78
GI4	METHYL ACETIC ACID-SUBSTITUTED GLUCOIMIDAZOLE	A,B	2J7G	0.71
CSH	[2-(2-HYDROXY-1-METHYL-ETHYL)-4- (1H-IMIDAZOL-4-YLMETHYL)-5-OXO- IMIDAZOLIDIN-1-YL]-ACETIC ACID	A	2EMN	0.84
CSH	[2-(2-HYDROXY-1-METHYL-ETHYL)-4- (1H-IMIDAZOL-4-YLMETHYL)-5-OXO- IMIDAZOLIDIN-1-YL]-ACETIC ACID	A	1EMF	0.84
CSH	[2-(2-HYDROXY-1-METHYL-ETHYL)-4- (1H-IMIDAZOL-4-YLMETHYL)-5-OXO- IMIDAZOLIDIN-1-YL]-ACETIC ACID	A	2EMD	0.84
CSH	[2-(2-HYDROXY-1-METHYL-ETHYL)-4- (1H-IMIDAZOL-4-YLMETHYL)-5-OXO- IMIDAZOLIDIN-1-YL]-ACETIC ACID	A	2EMO	0.84
HIA	L-HISTIDINE AMIDE	B	1URL	0.78
HS8	3-(1-sulfo-1H-imidazol-3-ium-4- yl)-L-alanine	A,B	3ETS	0.75
HS8	3-(1-sulfo-1H-imidazol-3-ium-4- yl)-L-alanine	A,B	3ETT	0.75
HIC	4-METHYL-HISTIDINE	A	2Q97	0.74
HIC	4-METHYL-HISTIDINE	A	1QZ6	0.74
HIC	4-METHYL-HISTIDINE	A	3CHW	0.74
HIC	4-METHYL-HISTIDINE	A,B	2GWK	0.74
HIC	4-METHYL-HISTIDINE	A,B,D,E	1MDU	0.74
HIC	4-METHYL-HISTIDINE	A	2ASO	0.74
HIC	4-METHYL-HISTIDINE	A,B	2D1K	0.74
HIC	4-METHYL-HISTIDINE	A,S	1C0F	0.74
HIC	4-METHYL-HISTIDINE	A,D	1ATN	0.74
HIC	4-METHYL-HISTIDINE	A,B	2A42	0.74
HIC	4-METHYL-HISTIDINE	A,P	2BTF	0.74
HIC	4-METHYL-HISTIDINE	A,B	1LOT	0.74
HIC	4-METHYL-HISTIDINE	A	1NWK	0.74
HIC	4-METHYL-HISTIDINE	A,S	1C0G	0.74
HIC	4-METHYL-HISTIDINE	A,S	1EQY	0.74
HIC	4-METHYL-HISTIDINE	A	2PAV	0.74
HIC	4-METHYL-HISTIDINE	A	2Q0U	0.74
HIC	4-METHYL-HISTIDINE	A,B	2HMP	0.74
HIC	4-METHYL-HISTIDINE	A	2PBD	0.74
HIC	4-METHYL-HISTIDINE	A,S	1DEJ	0.74
HIC	4-METHYL-HISTIDINE	A,S	1ESV	0.74
HIC	4-METHYL-HISTIDINE	A	1J6Z	0.74
HIC	4-METHYL-HISTIDINE	A	1WUA	0.74
HIC	4-METHYL-HISTIDINE	A,B	1YXQ	0.74
HIC	4-METHYL-HISTIDINE	A	1S22	0.74
HIC	4-METHYL-HISTIDINE	A,B,D,E	2A40	0.74
HIC	4-METHYL-HISTIDINE	A	1QZ5	0.74
HIC	4-METHYL-HISTIDINE	A	2ZWH	0.74
HIC	4-METHYL-HISTIDINE	A,B	2A41	0.74
HIC	4-METHYL-HISTIDINE	B	1MA9	0.74
HIC	4-METHYL-HISTIDINE	A,G	3CI5	0.74
HIC	4-METHYL-HISTIDINE	A	1Y64	0.74
HIC	4-METHYL-HISTIDINE	A,P	1HLU	0.74
HIC	4-METHYL-HISTIDINE	A,B	2A3Z	0.74
HIC	4-METHYL-HISTIDINE	A	2FXU	0.74
HIC	4-METHYL-HISTIDINE	A,G	3CIP	0.74
HIC	4-METHYL-HISTIDINE	A	2GWJ	0.74
HIC	4-METHYL-HISTIDINE	A,B	2VCP	0.74
CRG	[2-(1-AMINO-2-HYDROXY-PROPYL)-4- (3H-IMIDAZOL-4-YLMETHYLENE)-5-OXO- 4,5-DIHYDRO-IMIDAZOL-1-YL]-ACETIC ACID	A	1KYS	0.71
CRG	[2-(1-AMINO-2-HYDROXY-PROPYL)-4- (3H-IMIDAZOL-4-YLMETHYLENE)-5-OXO- 4,5-DIHYDRO-IMIDAZOL-1-YL]-ACETIC ACID	A	1KYR	0.71
CRG	[2-(1-AMINO-2-HYDROXY-PROPYL)-4- (3H-IMIDAZOL-4-YLMETHYLENE)-5-OXO- 4,5-DIHYDRO-IMIDAZOL-1-YL]-ACETIC ACID	A	1KYP	0.71
HIP	ND1-PHOSPHONOHISTIDINE	A,B,C,D,E,F	2VME	0.74
HIP	ND1-PHOSPHONOHISTIDINE	A	1NSP	0.74
HIP	ND1-PHOSPHONOHISTIDINE	A,B,C	1NSQ	0.74
HIP	ND1-PHOSPHONOHISTIDINE	A	1PFH	0.74
HIP	ND1-PHOSPHONOHISTIDINE	A	1JEM	0.74
DHI	D-HISTIDINE	P	1MCB	0.78
DHI	D-HISTIDINE	A	2EZ7	0.78
DHI	D-HISTIDINE	P	1MCN	0.78
DHI	D-HISTIDINE	A,D	1CZQ	0.78
DHI	D-HISTIDINE	I	1ER8	0.78
DHI	D-HISTIDINE	P	1MCL	0.78
DHI	D-HISTIDINE	A,B,C,D	3BOG	0.78
DHI	D-HISTIDINE	A,L	1ZEA	0.78
BDH	L-BETA-ASPARTYLHISTIDINE	A,B	1YBQ	0.8
HIQ	1-[1,2-DIHYDROXY-1-(HYDROXYMETHYL)ETHYL]- L-HISTIDINE	A,B	2IU4	0.75
AHN	N-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDE	A,B	2AFW	0.84
720	(2S)-5-AMINO-2-[(1-PROPYL-1H-IMIDAZOL- 4-YL)METHYL]PENTANOIC ACID	A	2JEW	0.72
IIC	4-IMIDAZOLMETHYLENE-5-IMIDAZOLONE CHROMOPHORE	A	1BFP	0.8
HSA	PHOSPHORIC ACID MONO-[2-AMINO-3- (3H-IMIDAZOL-4-YL)-PROPYL]ESTER	A	1GEX	0.74
HSA	PHOSPHORIC ACID MONO-[2-AMINO-3- (3H-IMIDAZOL-4-YL)-PROPYL]ESTER	A,B,C,D	1UU1	0.74
HSA	PHOSPHORIC ACID MONO-[2-AMINO-3- (3H-IMIDAZOL-4-YL)-PROPYL]ESTER	A	1FG3	0.74
3AH	[HISTIDIN-1-YL-4H-[1,2,4]TRIAZOL- 5-YL]-AMINE	A,B,C,D	1DGH	0.74
HSM	HISTAMINE	A,B	1U18	0.77
HSM	HISTAMINE	A	1AVN	0.77
HSM	HISTAMINE	A,B	1KAR	0.77
HSM	HISTAMINE	A,B	1NP1	0.77
HSM	HISTAMINE	A,B	1JQD	0.77
HSM	HISTAMINE	A,B	2QEB	0.77
HSM	HISTAMINE	A,B	1QFV	0.77
HSM	HISTAMINE	A	1IKE	0.77
HSM	HISTAMINE	A	3BU1	0.77
HSM	HISTAMINE	A,B	1QFT	0.77
HSO	HISTIDINOL	A,B	1H3J	0.77
HSO	HISTIDINOL	A,B,C,D	1KMN	0.77
HSO	HISTIDINOL	A,B	2FPU	0.77
HSO	HISTIDINOL	A,B	1KAE	0.77
HSO	HISTIDINOL	N	2BKD	0.77