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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01823095

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
152CARNITINEA,B1NDF0.7
152CARNITINEA,B1T7Q0.7
152CARNITINEA,B1XL80.7
152CARNITINEA,B2H3U0.7
152CARNITINEA1S5O0.7
152CARNITINEA1T7O0.7
152CARNITINEA,B2H3P0.7
PC7(7S)-4-HYDROXY-N,N,N-TRIMETHYL-
9-OXO-7-[(PALMITOYLOXY)METHYL]-
3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-
1-AMINIUM 4-OXIDE
H,L,M2HG90.7
PC7(7S)-4-HYDROXY-N,N,N-TRIMETHYL-
9-OXO-7-[(PALMITOYLOXY)METHYL]-
3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-
1-AMINIUM 4-OXIDE
H,L,M2HH10.7
PX41,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHOCHOLINEA,B3DDL0.7
TMD(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWK0.74
DM0N~2~,N~2~,N~6~,N~6~-tetramethyl-
L-lysine
A132L0.75
MG8N-OCTANOYL-N-METHYLGLUCAMINEA,B1SMH0.7
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1Q610.7
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1Q8U0.7
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1SVE0.7
LP3(7S)-4,7-DIHYDROXY-N,N,N-TRIMETHYL-
10-OXO-3,5,9-TRIOXA-4-PHOSPHAHEPTACOSAN-
1-AMINIUM 4-OXIDE
A,B2AG40.74
LP3(7S)-4,7-DIHYDROXY-N,N,N-TRIMETHYL-
10-OXO-3,5,9-TRIOXA-4-PHOSPHAHEPTACOSAN-
1-AMINIUM 4-OXIDE
A,B,C2AG20.74
LPC[1-MYRISTOYL-GLYCEROL-3-YL]PHOSPHONYLCHOLINEA,B1BWO0.74
LIO[1-PENTADECANOYL-2-DECANOYL-GLYCEROL-
3-YL]PHOSPHONYL CHOLINE
A,B1DLQ0.7
LIO[1-PENTADECANOYL-2-DECANOYL-GLYCEROL-
3-YL]PHOSPHONYL CHOLINE
A,B1DLM0.7
LIO[1-PENTADECANOYL-2-DECANOYL-GLYCEROL-
3-YL]PHOSPHONYL CHOLINE
A,B1DMH0.7
LIO[1-PENTADECANOYL-2-DECANOYL-GLYCEROL-
3-YL]PHOSPHONYL CHOLINE
A,B1DLT0.7
LAP[2-((1-OXODODECANOXY-(2-HYDROXY-
3-PROPANYL))-PHOSPHONATE-OXY)-ETHYL]-
TRIMETHYLAMMONIUM
A1MID0.74
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.71
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.71
PLDDIUNDECYL PHOSPHATIDYL CHOLINEA,B1LSH0.7
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.71
HGP(1-HEXADECANOYL-2-TETRADECANOYL-
GLYCEROL-3-YL) PHOSPHONYL CHOLINE
A,B1S9A0.7
QEH(7R)-4,7-DIHYDROXY-N,N,N-TRIMETHYL-
10-OXO-3,5,9-TRIOXA-4-PHOSPHAHEPTACOSAN-
1-AMINIUM 4-OXIDE
A2RKN0.74
OCBOCTANOYLCARNITINEA,B1XL80.84
6PL(4S,7R)-4-HYDROXY-N,N,N-TRIMETHYL-
9-OXO-7-[(PALMITOYLOXY)METHYL]-
3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-
1-AMINIUM 4-OXIDE
A,B3B7Q0.7
6PL(4S,7R)-4-HYDROXY-N,N,N-TRIMETHYL-
9-OXO-7-[(PALMITOYLOXY)METHYL]-
3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-
1-AMINIUM 4-OXIDE
A,B2H260.7
6PL(4S,7R)-4-HYDROXY-N,N,N-TRIMETHYL-
9-OXO-7-[(PALMITOYLOXY)METHYL]-
3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-
1-AMINIUM 4-OXIDE
A3B7Z0.7
PLCDIUNDECYL PHOSPHATIDYL CHOLINEA,C,D,E,N,P,
Q,R
3H1I0.7
PLCDIUNDECYL PHOSPHATIDYL CHOLINEA,B,C1EIN0.7
PLCDIUNDECYL PHOSPHATIDYL CHOLINEB1LPA0.7
PLCDIUNDECYL PHOSPHATIDYL CHOLINEA,C,D,E,G,N,
P,Q,R,S
3H1J0.7
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.71
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.71
DOA12-AMINO-DODECANOIC ACIDA2DCX0.71
DOA12-AMINO-DODECANOIC ACIDB1EOL0.71
LTA4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTERE,I1APT0.74
EXY6-[(2R)-oxiran-2-yl]-L-norleucineA,B3DJ80.73
HGX1-HEPTADECANOYL-2-TRIDECANOYL-3-
GLYCEROL-PHOSPHONYL CHOLINE
A,B1TMX0.7
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.73
HC5(R)-3-CARBOXY-2-(HEXANOYLOXY)-N,N,N-
TRIMETHYLPROPAN-1-AMINIUM
A,B2H3W0.78