MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02006149

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
TRN	NZ2-TRYPTOPHAN	A,B,C	1AM7	0.82
APT	2-AMINO-6-[(4-CARBOXY-PHENYLAMINO)- METHYL]-4-HYDROXY-PTERIDIN-1-IUM	A,B	1QCJ	0.73
PRR	3-(METHYL-PYRIDINIUM)ALANINE	H,I,J	7KME	0.76
JNK	N-{2'-[(4-FLUOROPHENYL)AMINO]-4,4'- BIPYRIDIN-2-YL}-4-METHOXYCYCLOHEXANECARBOXAMIDE	X	2EXC	0.72
BP5	3-(2,2'-BIPYRIDIN-5-YL)-L-ALANINE	A	2PXH	0.76
LZJ	6-(2,6-dibromophenyl)pyrido[2,3- d]pyrimidine-2,7-diamine	A,B	2V58	0.7
PT1	PTEROIC ACID	A,B	1TX0	0.74
PT1	PTEROIC ACID	A	1BR6	0.74
PT1	PTEROIC ACID	A,B	1HWP	0.74
PAA	(N-METHYLPYRIDYL)ACETIC ACID	I	1HBT	0.76
S91	[4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENYL]ACETIC ACID	A	2Z8C	0.77
S91	[4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENYL]ACETIC ACID	A	2Z7L	0.77
IMB	[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO- METHYL]-PHOSPHONIC ACID	A,B	1T1R	0.72
LZL	7-(2,5-dihydropyrrol-1-yl)-6-phenyl- pyrido[6,5-d]pyrimidin-2-amine	A,B	2V5A	0.73
PYI	1-[(4-AMINO-2-METHYLPYRIMIDIN-5- YL)METHYL]-3-(2-{[HYDROXY(PHOSPHONOOXY)PHOSPHORYL]OXY}ETHYL)- 2-METHYLPYRIDINIUM	A,B	2F17	0.73
PYI	1-[(4-AMINO-2-METHYLPYRIMIDIN-5- YL)METHYL]-3-(2-{[HYDROXY(PHOSPHONOOXY)PHOSPHORYL]OXY}ETHYL)- 2-METHYLPYRIDINIUM	A,B	3D2V	0.73
NFL	2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID	A	1TD7	0.76
AT2	ETHYL 4-[(4-METHYLPYRIDIN-2-YL)AMINO]PIPERIDINE- 1-CARBOXYLATE	A,B	3E7S	0.7
AT2	ETHYL 4-[(4-METHYLPYRIDIN-2-YL)AMINO]PIPERIDINE- 1-CARBOXYLATE	A,B	3E7M	0.7
AT2	ETHYL 4-[(4-METHYLPYRIDIN-2-YL)AMINO]PIPERIDINE- 1-CARBOXYLATE	A,B,C,D	3E7G	0.7
MTX	METHOTREXATE	A,B	1DRB	0.71
MTX	METHOTREXATE	A,B,C,D	2C7V	0.71
MTX	METHOTREXATE	A	1U70	0.71
MTX	METHOTREXATE	A,B,C,D	1MXF	0.71
MTX	METHOTREXATE	A	2QK8	0.71
MTX	METHOTREXATE	A,B	1RB3	0.71
MTX	METHOTREXATE	A,B	1DHJ	0.71
MTX	METHOTREXATE	A	3DAU	0.71
MTX	METHOTREXATE	A	1U72	0.71
MTX	METHOTREXATE	A,B	2DRC	0.71
MTX	METHOTREXATE	A,B	1D1G	0.71
MTX	METHOTREXATE	A,B	1DDR	0.71
MTX	METHOTREXATE	A,B	1E7W	0.71
MTX	METHOTREXATE	A	1RX3	0.71
MTX	METHOTREXATE	A	3DFR	0.71
MTX	METHOTREXATE	A,B,C,D	1P33	0.71
MTX	METHOTREXATE	A	3DAT	0.71
MTX	METHOTREXATE	A,B	1DHI	0.71
MTX	METHOTREXATE	A,B	1TDR	0.71
MTX	METHOTREXATE	A,B	1DRA	0.71
MTX	METHOTREXATE	A	3EIG	0.71
MTX	METHOTREXATE	A	3CD2	0.71
MTX	METHOTREXATE	A	1AO8	0.71
MTX	METHOTREXATE	A	1DF7	0.71
MTX	METHOTREXATE	A	1DLS	0.71
MTX	METHOTREXATE	A	1RG7	0.71
MTX	METHOTREXATE	A	1RH3	0.71
MTX	METHOTREXATE	A,B	4DFR	0.71
MTX	METHOTREXATE	A	1RA3	0.71
MTX	METHOTREXATE	A,B	1DDS	0.71
MTX	METHOTREXATE	A	1DRE	0.71
MTX	METHOTREXATE	A,B	1AXW	0.71
MTX	METHOTREXATE	A	3CL9	0.71
MTX	METHOTREXATE	A,B	3DRC	0.71
MTX	METHOTREXATE	A,B,C,D,E	2OIP	0.71
7CS	(3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT- 3-YL 1H-PYRROLO[2,3-B]PYRIDINE- 3-CARBOXYLATE	A	2QHM	0.71
FE1	METHYL 1-(4-{[(2,4-DIAMINOPTERIDIN- 6-YL)METHYL](METHYL)AMINO}BENZOYL)PIPERIDINE- 4-CARBOXYLATE	A,B,C,D	2QHX	0.71
855	2-(6-methylpyridin-2-yl)-N-pyridin- 4-ylquinazolin-4-amine	A	3HMM	0.7
MMG	4-(5-phenyl-1H-pyrrolo[2,3-b]pyridin- 3-yl)benzoic acid	A	3HDM	0.76
COP	N-(4-CARBOXY-4-{4-[(2,4-DIAMINO- PTERIDIN-6-YLMETHYL)-AMINO]-BENZOYLAMINO}- BUTYL)-PHTHALAMIC ACID	A	1OHJ	0.72
COP	N-(4-CARBOXY-4-{4-[(2,4-DIAMINO- PTERIDIN-6-YLMETHYL)-AMINO]-BENZOYLAMINO}- BUTYL)-PHTHALAMIC ACID	A	1OHK	0.72
1SQ	ISOQUINOLIN-1-AMINE	A	2OHK	0.73
218	1-[(4-AMINO-2-METHYLPYRIMIDIN-5- YL)METHYL]-3-(2-HYDROXYETHYL)-2- METHYLPYRIDINIUM	A	2HOP	0.76
PYA	3-(1,10-PHENANTHROL-2-YL)-L-ALANINE	A	1HCW	0.7
LIH	6-([5-QUINOLYLAMINO]METHYL)-2,4- DIAMINO-5-METHYLPYRIDO[2,3-D]PYRIMIDINE	A	1KMS	0.7
L1B	7-(2,4-DIAMINO-6-ETHYLPYRIMIDIN- 5-YL)-1-(3-METHOXYPROPYL)QUINOLINIUM	A,B	2G21	0.7
3BD	7-amino-2-tert-butyl-4-(4-pyrimidin- 2-ylpiperazin-1-yl)pyrido[2,3-d]pyrimidine- 6-carboxamide	A	3BAB	0.72
GMG	[4-(5-naphthalen-2-yl-1H-pyrrolo[2,3- b]pyridin-3-yl)phenyl]acetic acid	A	3HDN	0.78
4PP		C,L	1XKA	0.75
4PP		A,B,C,D	1XKB	0.75
NIO	NICOTINIC ACID	A	1JHQ	0.71
NIO	NICOTINIC ACID	A	1L5L	0.71
NIO	NICOTINIC ACID	A	2F7F	0.71
NIO	NICOTINIC ACID	A	1L5K	0.71
NIO	NICOTINIC ACID	A	1JHY	0.71
NIO	NICOTINIC ACID	A,B	1FSL	0.71
NIO	NICOTINIC ACID	A	1L5M	0.71
NIO	NICOTINIC ACID	A	1LH6	0.71
NIO	NICOTINIC ACID	A	1JHO	0.71
NIO	NICOTINIC ACID	A	3CI8	0.71
NIO	NICOTINIC ACID	A,B,C,D	1ICU	0.71
NIO	NICOTINIC ACID	A,B,C,D,E,F, G,H	3HRD	0.71
NIO	NICOTINIC ACID	A	1JHA	0.71
NIO	NICOTINIC ACID	A	1JHV	0.71
NIO	NICOTINIC ACID	A	1L4N	0.71
NIO	NICOTINIC ACID	A	2LH6	0.71
NIO	NICOTINIC ACID	A	1D0V	0.71
NIO	NICOTINIC ACID	A,B,C,D	1ICV	0.71
NIO	NICOTINIC ACID	A,B	1ICR	0.71
NIO	NICOTINIC ACID	A	1JHR	0.71
NIX	NALIDIXIC ACID	A,B	2BQ2	0.75
859	2-({2-[(3-HYDROXYPHENYL)AMINO]PYRIMIDIN- 4-YL}AMINO)BENZAMIDE	A,B	2NO3	0.7
24X		H,L	2EC9	0.74