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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02445048

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
6ULTETRACOSYL PALMITATEA,B2H260.76
DGADIACYL GLYCEROLA,C2NLJ0.8
DGADIACYL GLYCEROLA,C1ZWI0.8
DGADIACYL GLYCEROLB,C1R3J0.8
DGADIACYL GLYCEROLC1K4D0.8
DGADIACYL GLYCEROLA,C1K4C0.8
DGADIACYL GLYCEROLC1R3K0.8
DGADIACYL GLYCEROLB,C1S5H0.8
DGADIACYL GLYCEROLC,H1R3I0.8
DGADIACYL GLYCEROLB,C1R3L0.8
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.71
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.84
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.84
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.84
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Y0.82
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Z0.82
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.82
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.82
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.82
AZ1AZELAIC ACIDA,B1TUF0.83
BFC(R)-3-HYDROXYTETRADECANALA2NPV0.84
CN5(5S,11R)-5,8,11-trihydroxy-5,11-
dioxido-17-oxo-4,6,10,12,16-pentaoxa-
5,11-diphosphaoctadec-1-yl pentadecanoate		A,C,D,E,L,N,
O,P,W		3CX50.7
DCRicosanoic acidA,B,C,D3EUT0.84
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.76
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.93
CNSHEXADECYL OCTANOATEA,B1U9O0.78
CNSHEXADECYL OCTANOATEA1U9N0.78
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.8
4OX4-OXODECANEDIOIC ACIDA1GJP0.8
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.73
6NAHEXANOIC ACIDA,B2IX40.73
6NAHEXANOIC ACIDA,B2IWZ0.73
6NAHEXANOIC ACIDA2IQ00.73
DECSEBACIC ACIDA,B,C,D1CLS0.83
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C,E,F,G2ABM0.72
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y5I0.72
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y4Z0.72
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y5N0.72
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Q160.72
DAOLAURIC ACIDA,B2B5S0.88
DAOLAURIC ACID1,51V9U0.88
DAOLAURIC ACIDA2AF90.88
DAOLAURIC ACIDA2GFY0.88
DAOLAURIC ACIDA2GMC0.88
DAOLAURIC ACID11FPN0.88
DAOLAURIC ACIDA1QFF0.88
DAOLAURIC ACIDA,B1MA00.88
DAOLAURIC ACIDA,B,C1TJJ0.88
DAOLAURIC ACIDA2AGC0.88
DAOLAURIC ACID1,41AYM0.88
DAOLAURIC ACID1,41AYN0.88
DAOLAURIC ACIDA,B,C,D2BZ30.88
DAOLAURIC ACIDA2OVD0.88
DAOLAURIC ACIDA,B2ALG0.88
DAOLAURIC ACIDA,B,C,D3FXI0.88
DAOLAURIC ACIDA1FK10.88
DAOLAURIC ACIDA,B,C,D1EK40.88
DAOLAURIC ACIDA,B2QHD0.88
DAOLAURIC ACIDA2GMD0.88
DAOLAURIC ACIDA,B2GRX0.88
DAOLAURIC ACIDA1QFG0.88
DAOLAURIC ACIDA,B,C2AG20.88
DAOLAURIC ACIDA,E3DPR0.88
DAOLAURIC ACIDA,B,C,D2BYZ0.88
DAOLAURIC ACIDA1E7F0.88
DAOLAURIC ACIDA,B1HZP0.88
DAOLAURIC ACIDA,B,C,D2BYX0.88
DAOLAURIC ACIDA1S8G0.88
DAOLAURIC ACIDA,B,C,D1M7W0.88
DAOLAURIC ACIDA2EVD0.88
BRC12-BROMODODECANOIC ACIDA1BSO0.76