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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03201508

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.74
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.83
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.83
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.83
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Y0.83
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Z0.83
AZ1AZELAIC ACIDA,B1TUF0.8
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.71
BFC(R)-3-HYDROXYTETRADECANALA2NPV0.74
DGADIACYL GLYCEROLA,C2NLJ0.81
DGADIACYL GLYCEROLA,C1ZWI0.81
DGADIACYL GLYCEROLB,C1R3J0.81
DGADIACYL GLYCEROLC1K4D0.81
DGADIACYL GLYCEROLA,C1K4C0.81
DGADIACYL GLYCEROLC1R3K0.81
DGADIACYL GLYCEROLB,C1S5H0.81
DGADIACYL GLYCEROLC,H1R3I0.81
DGADIACYL GLYCEROLB,C1R3L0.81
BRC12-BROMODODECANOIC ACIDA1BSO0.7
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.84
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.88
DCRicosanoic acidA,B,C,D3EUT0.73
CS2D-MANNONIC ACIDA,B,C,D2QJM0.72
CS2D-MANNONIC ACIDA,B3DBN0.72
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.77
4OX4-OXODECANEDIOIC ACIDA1GJP0.77
DECSEBACIC ACIDA,B,C,D1CLS0.8
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B2NXG0.75
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B,C,D,E,F,
G,H,I,J,K,L		2NX30.75
DAOLAURIC ACIDA,B2B5S0.76
DAOLAURIC ACID1,51V9U0.76
DAOLAURIC ACIDA2AF90.76
DAOLAURIC ACIDA2GFY0.76
DAOLAURIC ACIDA2GMC0.76
DAOLAURIC ACID11FPN0.76
DAOLAURIC ACIDA1QFF0.76
DAOLAURIC ACIDA,B1MA00.76
DAOLAURIC ACIDA,B,C1TJJ0.76
DAOLAURIC ACIDA2AGC0.76
DAOLAURIC ACID1,41AYM0.76
DAOLAURIC ACID1,41AYN0.76
DAOLAURIC ACIDA,B,C,D2BZ30.76
DAOLAURIC ACIDA2OVD0.76
DAOLAURIC ACIDA,B2ALG0.76
DAOLAURIC ACIDA,B,C,D3FXI0.76
DAOLAURIC ACIDA1FK10.76
DAOLAURIC ACIDA,B,C,D1EK40.76
DAOLAURIC ACIDA,B2QHD0.76
DAOLAURIC ACIDA2GMD0.76
DAOLAURIC ACIDA,B2GRX0.76
DAOLAURIC ACIDA1QFG0.76
DAOLAURIC ACIDA,B,C2AG20.76
DAOLAURIC ACIDA,E3DPR0.76
DAOLAURIC ACIDA,B,C,D2BYZ0.76
DAOLAURIC ACIDA1E7F0.76
DAOLAURIC ACIDA,B1HZP0.76
DAOLAURIC ACIDA,B,C,D2BYX0.76
DAOLAURIC ACIDA1S8G0.76
DAOLAURIC ACIDA,B,C,D1M7W0.76
DAOLAURIC ACIDA2EVD0.76
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		3CX50.71
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C,E,F,G2ABM0.73
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y5I0.73
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y4Z0.73
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y5N0.73
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Q160.73
1LU4-METHYL-PENTANOIC ACID-2-OXYL GROUPE,I6TMN0.7
1LU4-METHYL-PENTANOIC ACID-2-OXYL GROUPI1DS20.7