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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03577780

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NCT(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T
1UW60.71
NCT(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINEA1P2Y0.71
NCT(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINEA1P7R0.71
368(1R)-2-{[AMINO(IMINO)METHYL]AMINO}-
1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2-
DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE
A1ZLR0.73
DRP2-DEOXYRIBOFURANOSYL-PYRIDINE-5'-
MONOPHOSPHATE
A,B1JES0.72
PRR3-(METHYL-PYRIDINIUM)ALANINEH,I,J7KME0.7
NNRNicotinamide ribosideA2QT00.75
NNRNicotinamide ribosideA2QT10.75
PCH3-AMINO-4-CYCLOHEXYL-1-(PYRIDIN-
4-YLOXY)BUTAN-2-OL
I1E820.7
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA2QSZ0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA1TA80.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA1HYB0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA3BAA0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA3BA90.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B1NUP0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B1NUS0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B1Y1P0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B,C,D,E,F2GVG0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA3BA80.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA3BAB0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B3DZK0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B,C1GZU0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B2H3D0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B2G960.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA2QG60.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B1ISJ0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B3DZJ0.73
NMNBETA-NICOTINAMIDE RIBOSE MONOPHOSPHATEA,B2HCT0.73
NCNNICOTINATE MONONUCLEOTIDEA,B2QTN0.76
NCNNICOTINATE MONONUCLEOTIDEA1L4F0.76
NCNNICOTINATE MONONUCLEOTIDEA1L4L0.76
NCNNICOTINATE MONONUCLEOTIDEA,B,C,D1YUM0.76
NCNNICOTINATE MONONUCLEOTIDEA1L4M0.76
NCNNICOTINATE MONONUCLEOTIDEA,B,C,D,E,F1QPN0.76
NCNNICOTINATE MONONUCLEOTIDEA,B,C2B7Q0.76
NCNNICOTINATE MONONUCLEOTIDEA1L4K0.76
NCNNICOTINATE MONONUCLEOTIDEA1L4G0.76
NCNNICOTINATE MONONUCLEOTIDEA1YTK0.76
NCNNICOTINATE MONONUCLEOTIDEA1L4H0.76
NCNNICOTINATE MONONUCLEOTIDEA1L5O0.76
GPI(2S)-[3-PYRIDYL-1-PROPYL]-1-[3,3-
DIMETHYL-1,2-DIOXOPENTYL]-2-PYRROLIDINECARBOXYLATE
A1F400.73
IMQ(2R,3R,4S)-2-(hydroxymethyl)-1-
(quinolin-8-ylmethyl)pyrrolidine-
3,4-diol
A,B3EPX0.75
EHD4-ETHYL-4-HYDROXY-1,12-DIHYDRO-
4H-2-OXA-6,12A-DIAZA-DIBENZO[B,H]FLUORENE-
3,13-DIONE
A,C,D1T8I0.71