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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02044284

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1DG(4R)-ISONICOTINIC-ACETYL-NICOTINAMIDE-
ADENINE DINUCLEOTIDE
A2CIG0.74
4HI(3R,5R)-7-[4-(benzylcarbamoyl)-
2-(4-fluorophenyl)-5-(1-methylethyl)-
1H-imidazol-1-yl]-3,5-dihydroxyheptanoic acid
B,C,D3CCW0.75
8FGN-(5'-PHOSPHO-2'-DEOXYGUANOSIN-
8-YL)-2-ACETYLAMINOFLUORENE
A,C,D1X9M0.87
5HI(3R,5R)-7-[2-(4-fluorophenyl)-4-
{[(1S)-2-hydroxy-1-phenylethyl]carbamoyl}-
5-(1-methylethyl)-1H-imidazol-1-
yl]-3,5-dihydroxyheptanoic acid
A,B,C,D3CCZ0.75
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZG0.75
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA1DRV0.75
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B2EWD0.75
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZF0.75
3BK(2R,3R,4S,5R)-2-[6-amino-8-[(3,4-
dichlorophenyl)methylamino]purin-
9-yl]-5-(hydroxymethyl)oxolane-
3,4-diol
A3FZK0.75
6HI(3R,5R)-7-{2-[(4-fluorobenzyl)carbamoyl]-
4-(4-fluorophenyl)-1-(1-methylethyl)-
1H-imidazol-5-yl}-3,5-dihydroxyheptanoic acid
B,C,D3CD00.71
ABR(R)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5E0.75
2ND2'-DEOXYINOSINEA1Z390.7
1RB1-ALPHA-D-RIBOFURANOSYL-BENZIMIAZOLE-
5'-PHOSPHATE
A1L5K0.73
8IDNICOTINAMIDE-8-IODO-ADENINE-DINUCLEOTIDEA,B,C,D2HCY0.74
B12COBALAMINA3GAI0.7
B12COBALAMINA,C,E,G1DDY0.7
B12COBALAMINA3CI30.7
B12COBALAMINA3REQ0.7
B12COBALAMINA3GAH0.7
B12COBALAMINA,B1G640.7
B12COBALAMINA,B,C,D1REQ0.7
B12COBALAMINA,B2BB50.7
B12COBALAMINA,B,C,D7REQ0.7
B12COBALAMINA,B,C,D2BB60.7
B12COBALAMINA3GAJ0.7
B12COBALAMINA,B,E,L1IWB0.7
B12COBALAMINA,B,C,D5REQ0.7
B12COBALAMINA,C2REQ0.7
B12COBALAMINA,B,C,D4REQ0.7
B12COBALAMINA,C2PMV0.7
B12COBALAMINA3CI10.7
B12COBALAMINA3BUL0.7
B12COBALAMINA,B,E,L1IWP0.7
B12COBALAMINA1K7Y0.7
B12COBALAMINA,B,E,L1MMF0.7
B12COBALAMINA1K980.7
B12COBALAMINA2V3N0.7
B12COBALAMINA,B,E,L1DIO0.7
B12COBALAMINA,C1E1C0.7
B12COBALAMINA2V3P0.7
B12COBALAMINA,C6REQ0.7
B12COBALAMINA,B,C,D1I9C0.7
B12COBALAMINB1XRS0.7
B12COBALAMINA,B2H9A0.7
B12COBALAMINA2BBC0.7
BPG9-(4-HYDROXYBUTYL)-N2-PHENYLGUANINEA,B1QHI0.82
3AA3-AMINOPYRIDINE-ADENINE DINUCLEOTIDE PHOSPHATEA,B,E,F1F6M0.71
AGNA1GNP0.8
CA3COA-S-TRIMETHYLENE-ACETYL-TRYPTAMINEA1KUX0.7
ABS(S)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5F0.75
3DG9-(3-DEOXY-BETA-D-RIBOFURANOSYL)GUANINEE1V450.7
AD33-DEAZA-ADENOSINEA,B1KIE0.74
AD33-DEAZA-ADENOSINEA,B,C,D2ZIZ0.74
AD33-DEAZA-ADENOSINEA,B1R4F0.74
AD33-DEAZA-ADENOSINEA,B1HP00.74
1DA1-DEAZA-ADENOSINEA1ADD0.73