MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02354697

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
FOL	FOLIC ACID	A	1PJ6	0.71
FOL	FOLIC ACID	A,B	1RD7	0.71
FOL	FOLIC ACID	A,B	1DHF	0.71
FOL	FOLIC ACID	A,B,C,D,E	1QZF	0.71
FOL	FOLIC ACID	A	4CD2	0.71
FOL	FOLIC ACID	A	1RX7	0.71
FOL	FOLIC ACID	A	1RX2	0.71
FOL	FOLIC ACID	A	1RX8	0.71
FOL	FOLIC ACID	A	1RA2	0.71
FOL	FOLIC ACID	A,B	1RE7	0.71
FOL	FOLIC ACID	A	7DFR	0.71
FOL	FOLIC ACID	A	1VIF	0.71
FOL	FOLIC ACID	A,B	1RB2	0.71
FOL	FOLIC ACID	A	1CD2	0.71
FOL	FOLIC ACID	A	2CD2	0.71
FOL	FOLIC ACID	A,B	1DYI	0.71
FOL	FOLIC ACID	A	1DRF	0.71
FOL	FOLIC ACID	A,B,C,D	3BMC	0.71
FOL	FOLIC ACID	A,B	2D0K	0.71
FOL	FOLIC ACID	A	1RA8	0.71
NNO	6-HYDROXYISONICOTINIC ACID N-OXIDE	M,N,O,P,Q,R	3PCK	0.74
NNO	6-HYDROXYISONICOTINIC ACID N-OXIDE	M,N,O,P,Q,R	3PCM	0.74
NCA	NICOTINAMIDE	A,B	2E5D	0.74
NCA	NICOTINAMIDE	A,B,C,D	2Z77	0.74
NCA	NICOTINAMIDE	A,B	1DMA	0.74
NCA	NICOTINAMIDE	A,B	1ISM	0.74
NCA	NICOTINAMIDE	A,B	1YC5	0.74
NCA	NICOTINAMIDE	A	2ZB7	0.74
NCA	NICOTINAMIDE	A,B,C,D,E,F, G,H	1R15	0.74
NCA	NICOTINAMIDE	A,B	2QQG	0.74
NCA	NICOTINAMIDE	A	2OTV	0.74
NCA	NICOTINAMIDE	A	2QHF	0.74
NCA	NICOTINAMIDE	A,B,C,D	2C8A	0.74
NCA	NICOTINAMIDE	A,B	2HJH	0.74
NCA	NICOTINAMIDE	A	2A15	0.74
NCA	NICOTINAMIDE	A	2R6V	0.74
NCA	NICOTINAMIDE	A,B	1ISI	0.74
NCA	NICOTINAMIDE	A,D,E	2R9J	0.74
NCA	NICOTINAMIDE	A	2H4J	0.74
NCA	NICOTINAMIDE	A,B	2OD9	0.74
NCA	NICOTINAMIDE	A,B,C,D,E	1YC2	0.74
NCA	NICOTINAMIDE	A,B	3DZG	0.74
NCA	NICOTINAMIDE	A	1OJU	0.74
NFL	2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID	A	1TD7	0.83
368	(1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE	A	1ZLR	0.74
NNR	Nicotinamide riboside	A	2QT0	0.71
NNR	Nicotinamide riboside	A	2QT1	0.71
OPN	{(2-AMINO-ETHYL)-[2-(2-OXO-1,2- DIHYDRO-[1,8]NAPHTHYRIDIN-3-YL)- ACETYL]-AMINO}-ACETIC ACID	A,B,C,D	1HZS	0.78
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1S1X	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1LWE	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1LW0	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	2HND	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1FKP	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1S1U	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1LWF	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	2HNY	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1VRT	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1LWC	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1JLB	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	3HVT	0.75
NVP	11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL- 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN- 6-ONE	A	1JLF	0.75
608	N-(4-phenoxyphenyl)-2-[(pyridin- 4-ylmethyl)amino]nicotinamide	A,B	2P2I	0.72
AXD	2-[4-({2-[(2S,5R)-2-(AMINOMETHYL)- 5-ETHYNYLPYRROLIDIN-1-YL]-2-OXOETHYL}AMINO)- 4-METHYLPIPERIDIN-1-YL]ISONICOTINIC ACID	B	2I03	0.74
NIX	NALIDIXIC ACID	A,B	2BQ2	0.7
859	2-({2-[(3-HYDROXYPHENYL)AMINO]PYRIMIDIN- 4-YL}AMINO)BENZAMIDE	A,B	2NO3	0.73
NIO	NICOTINIC ACID	A	1JHQ	0.8
NIO	NICOTINIC ACID	A	1L5L	0.8
NIO	NICOTINIC ACID	A	2F7F	0.8
NIO	NICOTINIC ACID	A	1L5K	0.8
NIO	NICOTINIC ACID	A	1JHY	0.8
NIO	NICOTINIC ACID	A,B	1FSL	0.8
NIO	NICOTINIC ACID	A	1L5M	0.8
NIO	NICOTINIC ACID	A	1LH6	0.8
NIO	NICOTINIC ACID	A	1JHO	0.8
NIO	NICOTINIC ACID	A	3CI8	0.8
NIO	NICOTINIC ACID	A,B,C,D	1ICU	0.8
NIO	NICOTINIC ACID	A,B,C,D,E,F, G,H	3HRD	0.8
NIO	NICOTINIC ACID	A	1JHA	0.8
NIO	NICOTINIC ACID	A	1JHV	0.8
NIO	NICOTINIC ACID	A	1L4N	0.8
NIO	NICOTINIC ACID	A	2LH6	0.8
NIO	NICOTINIC ACID	A	1D0V	0.8
NIO	NICOTINIC ACID	A,B,C,D	1ICV	0.8
NIO	NICOTINIC ACID	A,B	1ICR	0.8
NIO	NICOTINIC ACID	A	1JHR	0.8
NCN	NICOTINATE MONONUCLEOTIDE	A,B	2QTN	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4F	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4L	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C,D	1YUM	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4M	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C,D,E,F	1QPN	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A,B,C	2B7Q	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4K	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4G	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A	1YTK	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A	1L4H	0.71
NCN	NICOTINATE MONONUCLEOTIDE	A	1L5O	0.71
24X		H,L	2EC9	0.75
DZF	5-DEAZAFOLIC ACID	A,B	2DHF	0.75
DZF	5-DEAZAFOLIC ACID	A,B	1DYH	0.75
DZF	5-DEAZAFOLIC ACID	A,B,C,D	1CDE	0.75
6PC	PYRIDINE-2-CARBOXYLIC ACID	A	2OLN	0.71
6PC	PYRIDINE-2-CARBOXYLIC ACID	A	2OLO	0.71
NTM	QUINOLINIC ACID	A	3C2O	0.77
NTM	QUINOLINIC ACID	A,B	1QAP	0.77
NTM	QUINOLINIC ACID	A,B,C,D,E,F	1QPQ	0.77
NTM	QUINOLINIC ACID	A,B,C	2B7N	0.77
3BD	7-amino-2-tert-butyl-4-(4-pyrimidin- 2-ylpiperazin-1-yl)pyrido[2,3-d]pyrimidine- 6-carboxamide	A	3BAB	0.7
NA4	4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID	A,C	1RHM	0.71