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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03796398

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CTSCASTANOSPERMINEA1EQC0.72
CTSCASTANOSPERMINEA,B2JKP0.72
CTSCASTANOSPERMINEA,B,C2VL80.72
CTSCASTANOSPERMINEA,B2CBU0.72
CTSCASTANOSPERMINEA,B2PWG0.72
CHK6-[(CYCLOHEXYLACETYL)(2-HYDROXYETHYL)AMINO]-
6-DEOXY-D-XYLO-HEXITOL
B1Y010.71
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.82
233[5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YLCARBAMOYL)-
PENTYL]-CARBAMIC ACID METHYL ESTER
D,E,F,G,H1MD20.71
W726-DEOXY-6-[(2R,3R,4R)-3,4-DIHYDROXY-
2-(HYDROXYMETHYL)PYRROLIDIN-1-YL]-
L-GULONIC ACID
A2FYV0.79
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.75
NOJ1-DEOXYNOJIRIMYCINA,B2J770.75
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.75
NOJ1-DEOXYNOJIRIMYCINA3GBE0.75
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.75
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.75
NOJ1-DEOXYNOJIRIMYCINA1DOG0.75
NOJ1-DEOXYNOJIRIMYCINA,B1I750.75
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.75
HG91-DEOXY-1-[(2-HYDROXYETHYL)(NONANOYL)AMINO]HEXITOLA,B,C,D1SO20.74
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.75
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.75
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.75
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.75
QGA1-[(3-CYCLOHEXYLPROPANOYL)(2-HYDROXYETHYL)AMINO]-
1-DEOXY-D-ALLITOL
A,B2JGQ0.7
LP66-piperidin-1-yl-L-norleucineA,B2W7Z0.7
MG8N-OCTANOYL-N-METHYLGLUCAMINEA,B1SMH0.76
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1Q610.76
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1Q8U0.76
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1SVE0.76
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.85
NAU4,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDONONANOIC ACIDA,C1F7B0.71
MDPN-CARBOXY-N-METHYL-MURAMIC ACID1,2,3,4,A,C,
E,G
1LOC0.71
HC5(R)-3-CARBOXY-2-(HEXANOYLOXY)-N,N,N-
TRIMETHYLPROPAN-1-AMINIUM
A,B2H3W0.7