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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02252738

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.71
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVK0.72
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2DWD0.72
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEC2DWE0.72
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVJ0.72
NORCYCLOHEXYL-NORSTATINEE,I1EPN0.71
NORCYCLOHEXYL-NORSTATINEP1CZI0.71
NORCYCLOHEXYL-NORSTATINEA,I1GVT0.71
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.73
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.73
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.73
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.76
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.71
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Y0.72
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Z0.72
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.72
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.72
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.72
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.71
DGADIACYL GLYCEROLA,C2NLJ0.7
DGADIACYL GLYCEROLA,C1ZWI0.7
DGADIACYL GLYCEROLB,C1R3J0.7
DGADIACYL GLYCEROLC1K4D0.7
DGADIACYL GLYCEROLA,C1K4C0.7
DGADIACYL GLYCEROLC1R3K0.7
DGADIACYL GLYCEROLB,C1S5H0.7
DGADIACYL GLYCEROLC,H1R3I0.7
DGADIACYL GLYCEROLB,C1R3L0.7
HOC(2S)-2-HYDROXYOCTANOIC ACIDA2A850.75