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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02470774

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DPB(S)-1-[2'-DEOXY-3',5'-O-(1-PHOSPHONO)BENZYLIDENE-
B-D-THREO-PENTOFURANOSYL]THYMINE
A1Q910.72
BZDA1K060.77
BZDA1K080.77
BZDA2QNB0.77
F59N-[(biphenyl-4-ylcarbonyl)carbamoyl]-
beta-D-glucopyranosylamine
A2QLN0.74
NBXN-{[(4-aminophenyl)carbonyl]carbamoyl}-
beta-D-glucopyranosylamine
A2QN90.72
SOS[(1R,2S,4R)-4-({2-AMINO-5-[BENZYL(FORMYL)AMINO]-
6-OXO-1,6-DIHYDROPYRIMIDIN-4-YL}AMINO)-
2-HYDROXYCYCLOPENTYL]METHYL DIHYDROGEN PHOSPHATE
A,B3C580.71
BOEA,B1YBC0.77
XCY{5-[4-{[4-(AMINOMETHYL)BENZYL]AMINO}-
2-OXOPYRIMIDIN-1(2H)- YL]-3-HYDROXYTETRAHYDROFURAN-
2-YL}METHYL DIHYDROGEN PHOSPHATE
A,B,C,D,F1YFH0.78
1821-((2-HYDROXYETHOXY)METHYL)-5-(PHENYLSELANYL)PYRIMIDINE-
2,4(1H,3H)-DIONE
A,B,C,D,E,F1U1E0.71
F68N-{[(4-methylphenyl)carbonyl]carbamoyl}-
beta-D-glucopyranosylamine
A2QLM0.76
F55N-{[(4-chlorophenyl)carbonyl]carbamoyl}-
beta-D-glucopyranosylamine
A2QN30.72
DUX2,3-DEOXY-3-FLUORO-5-O-TRITYLURIDINEA,B,C1VYQ0.75
BAU1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE-
2,4(1H,3H)-DIONE
A,B,C,D,E,F1U1C0.76
BAU1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE-
2,4(1H,3H)-DIONE
A,B,C,D3EUF0.76
UPPPHENYL-URIDINE-5'-DIPHOSPHATEA,B2UDP0.71
UPPPHENYL-URIDINE-5'-DIPHOSPHATEA,B3BXO0.71