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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01874101

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DOT3'ANTHRANILOYL-2'-DEOXY-ADENOSINE-
5'-TRIPHOSPHATE
A,B,C,D,E,F1LVC0.77
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B,C,D,E,F1KQO0.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B2H290.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B1NUQ0.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA1WXG0.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B,C,D,E,F1KAQ0.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B1EE10.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B,C,D3E270.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA1XQD0.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B2H2A0.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B1IFX0.73
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B1XNG0.73
4RB4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2-
b]pyridazin-3-yl)benzoic acid
A3BQR0.71
CND5-BETA-D-RIBOFURANOSYLNICOTINAMIDE ADENINE DINUCLEOTIDEA,B1ADB0.72
ONAA,C2GVZ0.76
LNC(3S)-5-(3-CARBOXY-3-HYDROXYPROPYL) NICOTINAMIDE-
ADENINE-DINUCLEOTIDE
A,B5LDH0.71
PT1PTEROIC ACIDA,B1TX00.7
PT1PTEROIC ACIDA1BR60.7
PT1PTEROIC ACIDA,B1HWP0.7
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZG0.7
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA1DRV0.7
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B2EWD0.7
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZF0.7
7CS(3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-
3-YL 1H-PYRROLO[2,3-B]PYRIDINE-
3-CARBOXYLATE
A2QHM0.74
PVBPURVALANOLA1CKP0.73
PVBPURVALANOLA,B1V0P0.73
CBB1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE-
2-CARBOXYLIC ACID 3-CARBAMIMIDOYL-
BENZYLESTER
B1LPK0.7
GS22-[(2-{[1-(N,N-dimethylglycyl)-
5-methoxy-1H-indol-6-yl]amino}-
7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-
6-fluoro-N-methylbenzamide
A3EKK0.71
AGNA1GNP0.71
NXXA,B,C,D3DLA0.73
NXXA,B,C2QTR0.73
090N-(2,3-DIHYDRO-7,8-DIMETHOXYIMIDAZO[1,2-
C] QUINAZOLIN-5-YL)NICOTINAMIDE
A2CHX0.7
GRDbenzyl (S)-1-((2S,3S)-1-(3-(6-amino-
9H-purin-9-yl)propylamino)-2-hydroxy-
1-oxopentan-3-ylamino)-4-methyl-
1-oxopentan-2-ylcarbamate
A2R9C0.71
MNT2'(3')-O-N-METHYLANTHRANILOYL-ADENOSINE-
5'-DIPHOSPHATE
A1LVK0.76
ONM3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE-
5'-TRIPHOSPHATE
A,C1TL70.71
ONM3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE-
5'-TRIPHOSPHATE
A,C1U0H0.71
C243-({2-[(4-CARBAMIMIDOYL-PHENYLAMINO)-
METHYL]-3-METHYL-3H-BENZOIMIDAZOLE-
5-CARBONYL}-PYRIDIN-2-YL-AMINO)-
PROPIONIC ACID ETHYL ESTER
B,C1KTS0.71