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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02325915

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
EOD11-[(2R,3S)-3-PENTYLOXIRAN-2-YL]UNDECANOIC ACIDA,B,C2DIO0.75
BFC(R)-3-HYDROXYTETRADECANALA2NPV0.74
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.77
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.77
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.77
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.79
E4H(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL-
4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2HFK0.71
PAYOCTANE-1,3,5,7-TETRACARBOXYLIC ACIDA,B2V770.74
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.73
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.76
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.76
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.76
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Y0.76
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Z0.76
OOA3-OXOOCTANOIC ACIDA,B,C,D1H0M0.7
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA2FCP0.82
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA1FCP0.82
TWN(3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN-
2-YL]BUTYL LAURATE
A,B2IVD0.76
TWN(3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN-
2-YL]BUTYL LAURATE
A,B2IVE0.76
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.85
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.85
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.85
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.85
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.85
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.85
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.85
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.85
DGADIACYL GLYCEROLA,C2NLJ0.75
DGADIACYL GLYCEROLA,C1ZWI0.75
DGADIACYL GLYCEROLB,C1R3J0.75
DGADIACYL GLYCEROLC1K4D0.75
DGADIACYL GLYCEROLA,C1K4C0.75
DGADIACYL GLYCEROLC1R3K0.75
DGADIACYL GLYCEROLB,C1S5H0.75
DGADIACYL GLYCEROLC,H1R3I0.75
DGADIACYL GLYCEROLB,C1R3L0.75
DGG1-[GLYCEROLYLPHOSPHONYL]-2-[8-(2-
HEXYL-CYCLOPROPYL)-OCTANAL-1-YL]-
3-[HEXADECANAL-1-YL]-GLYCEROL
A,B1CQX0.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVK0.76
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2DWD0.76
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEC2DWE0.76
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVJ0.76
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.74
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.72
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.85
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.85
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.85
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.85
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.85
F24(3R,5S,7R,12S,13R)-13-FORMYL-12,14-
DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID
A2F9A0.86
LIM3-OXO-PENTADECANOIC ACIDA2FCP0.72
LIM3-OXO-PENTADECANOIC ACIDA1UJW0.72
LIM3-OXO-PENTADECANOIC ACIDA1FCP0.72
GVM(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACIDA,B2UW10.78
HOC(2S)-2-HYDROXYOCTANOIC ACIDA2A850.73
STASTATINEE1EPP0.72
STASTATINEI1XN30.72
STASTATINEA,B,I,J2FIV0.72
STASTATINEA,B,C,D1QS80.72
STASTATINEA,B2RMP0.72
STASTATINEE,I1APU0.72
STASTATINEA,I1GVU0.72
STASTATINEI3ER50.72
STASTATINEI2ER90.72
STASTATINEE,I4ER20.72
STASTATINEA,C,I,J,K2B7F0.72
STASTATINEA,B,C5HVP0.72
STASTATINEA,I1GVV0.72
STASTATINEA,I1WKR0.72
STASTATINEI5APR0.72
STASTATINEI1PSO0.72
STASTATINEI6APR0.72
STASTATINEA1FQ50.72
STASTATINEA,I3FNT0.72
STASTATINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
3FV30.72
STASTATINEA,B,C,D,I,J1LYB0.72
STASTATINEB1FIV0.72
STASTATINEI4APR0.72
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1E800.7
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1EED0.7
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I2ER00.7
YML[(3R,4S,5S,7R)-4,8-DIHYDROXY-3,5,7-
TRIMETHYL-2-OXOOCTYL]PHOSPHONIC ACID
A,B2HFJ0.73