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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03399894

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA2FCP0.71
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA1FCP0.71
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
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
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.72
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
HOC(2S)-2-HYDROXYOCTANOIC ACIDA2A850.79
EOD11-[(2R,3S)-3-PENTYLOXIRAN-2-YL]UNDECANOIC ACIDA,B,C2DIO0.74
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERA,B2ERV0.71
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERX1UYN0.71
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERA1P4T0.71
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERX1UYO0.71
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERA,B3FID0.71
TGLTRISTEAROYLGLYCEROLA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2DYR0.71
TGLTRISTEAROYLGLYCEROLA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2EIM0.71
TGLTRISTEAROYLGLYCEROLA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2EIL0.71
TGLTRISTEAROYLGLYCEROLA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2DYS0.71
TGLTRISTEAROYLGLYCEROLA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z		2EIJ0.71
TGLTRISTEAROYLGLYCEROLA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z		1V540.71
TGLTRISTEAROYLGLYCEROLA,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z		2ZXW0.71
TGLTRISTEAROYLGLYCEROLA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z		2EIK0.71
TGLTRISTEAROYLGLYCEROLA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z		1V550.71
TGLTRISTEAROYLGLYCEROLA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z		2EIN0.71
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE		A,B1EKH0.71
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE		A,B1EKI0.71
PGT(1S)-2-{[{[(2R)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL STEARATE		H,L,M2HHK0.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B,C2W6U0.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B,C2W160.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B,C2W760.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B,C2W780.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B,C,D1WDK0.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B,C2W6T0.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B2W750.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A1TV50.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B2O5P0.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B,C,D1WDL0.71
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL		A,B,C2W770.71
C10HEXAETHYLENE GLYCOL MONODECYL ETHERA,B2BHI0.71
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.73
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2R8A0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2VQI0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA2POR0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H350.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C2F1T0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,D,E2GR70.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA5PRN0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2QTK0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1PRN0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1HXT0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFP0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1NQG0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA7PRN0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEX3DWO0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H390.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2BIX0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H3B0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1O6H0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1QJP0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2ODJ0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFO0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B3BRY0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA3BRZ0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFQ0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA2ZFG0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1BXW0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFN0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C2O4V0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,C1ETH0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1O6Q0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEX2F1C0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1BH30.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1O790.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C3DZM0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2SQC0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA8PRN0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1O6R0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA2PRN0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B3BS00.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1QJ80.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H3A0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1MPF0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1NQH0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1GSZ0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1NQE0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1HXX0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H370.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B1T160.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFM0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B1GZM0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA3PRN0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA2OMF0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1UMP0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H360.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H3C0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA3C9L0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA6PRN0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1NQF0.71
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA3POR0.71
HTOHEPTANE-1,2,3-TRIOLH,L,M2HH10.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWT0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXK0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M1RZH0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2HG30.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX30.74
HTOHEPTANE-1,2,3-TRIOLA2PIL0.74
HTOHEPTANE-1,2,3-TRIOLA,B1U190.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8D0.74
HTOHEPTANE-1,2,3-TRIOLA,B,C,D3DTU0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX40.74
HTOHEPTANE-1,2,3-TRIOLA,B1HZX0.74
HTOHEPTANE-1,2,3-TRIOLA,B2G870.74
HTOHEPTANE-1,2,3-TRIOLA,B2PED0.74
HTOHEPTANE-1,2,3-TRIOLC,H,L,M3D380.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWV0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M1RG50.74
HTOHEPTANE-1,2,3-TRIOLA1KMO0.74
HTOHEPTANE-1,2,3-TRIOLC,H,L,M1L9B0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWU0.74
HTOHEPTANE-1,2,3-TRIOLA1AY20.74
HTOHEPTANE-1,2,3-TRIOLA,B1RP00.74
HTOHEPTANE-1,2,3-TRIOLC,H,L,M2I5N0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8C0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2HJ60.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXJ0.74
HTOHEPTANE-1,2,3-TRIOLL,M1YF60.74
HTOHEPTANE-1,2,3-TRIOLB2BF30.74
HTOHEPTANE-1,2,3-TRIOLA,B2HPY0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX50.74
HTOHEPTANE-1,2,3-TRIOLL,M,X2UXM0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXL0.74
HTOHEPTANE-1,2,3-TRIOLA,B1L9H0.74
HTOHEPTANE-1,2,3-TRIOLA2HI20.74
HTOHEPTANE-1,2,3-TRIOLA,B,D,E,G,H,
J,K		1LGH0.74
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWW0.74
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.73
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.73
PGM1-MYRISTOYL-2-HYDROXY-SN-GLYCERO-
3-[PHOSPHO-RAC-(1-GLYCEROL)]		A1N890.72
PGM1-MYRISTOYL-2-HYDROXY-SN-GLYCERO-
3-[PHOSPHO-RAC-(1-GLYCEROL)]		A1TUK0.72
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
HHG(2R)-2-HYDROXY-3-(PHOSPHONOOXY)PROPYL HEXANOATEA1Y9T0.73
HHG(2R)-2-HYDROXY-3-(PHOSPHONOOXY)PROPYL HEXANOATEA,B3E3C0.73
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVK0.82
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2DWD0.82
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEC2DWE0.82
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVJ0.82
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,E,F,
G,H,I,J		2CYD0.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,E,F,
G,H,I,J		2DB40.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z		3BZ20.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C2BHW0.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,E,F,
G,H,I,J		2BL20.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,F,I,J,
K,L,M,X		1JB00.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,F,H,
K,L,T,V,Z		3A0H0.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,F,H,
I,K,L,M,T,V,X		2AXT0.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,E,H,
J,K,L,T,V,Z		3A0B0.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,E,F,
G,H,I,J		1RWT0.71
LHG1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLEA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z		3BZ10.71
ARI[O4]-ACETOXY-2,3-DIDEOXYFUCOSEA,B1D830.71
ARI[O4]-ACETOXY-2,3-DIDEOXYFUCOSEA,B,C,D1VAQ0.71
IN1PROPIONIC ACID 2,2-DIHYDROXY-3-
(1-GLUCOPYRANOSYLOXY)-METHYLPROPYL ESTER		A,B4OVW0.71