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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02249877

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
6ULTETRACOSYL PALMITATEA,B2H260.71
CNSHEXADECYL OCTANOATEA,B1U9O0.73
CNSHEXADECYL OCTANOATEA1U9N0.73
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.71
4OX4-OXODECANEDIOIC ACIDA1GJP0.71
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.7
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.71
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.72
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.72
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.72
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.72
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.72
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.73
TWN(3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN-
2-YL]BUTYL LAURATE
A,B2IVD0.8
TWN(3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN-
2-YL]BUTYL LAURATE
A,B2IVE0.8
T80METHYLPENTA(OXYETHYL) HEPTADECANOATEA,B1LBT0.72
NONMETHYL NONANOATE (ESTER)A1QQS0.71
NONMETHYL NONANOATE (ESTER)H1CLZ0.71
NONMETHYL NONANOATE (ESTER)H1CLY0.71
F24(3R,5S,7R,12S,13R)-13-FORMYL-12,14-
DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID
A2F9A0.72