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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02502075

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
9HO(9S,10E,12Z)-9-hydroxyoctadeca-
10,12-dienoic acid		A,B2VSR0.72
CN3(2R,5S,11R,14R)-5,8,11-trihydroxy-
2-(nonanoyloxy)-5,11-dioxido-16-
oxo-14-[(propanoyloxy)methyl]-4,6,10,12,15-
pentaoxa-5,11-diphosphanonadec-
1-yl undecanoate		A,C,D,E,L,N,
O,P,W		3CX50.7
2SP(1S)-2-(PHOSPHONOOXY)-1-[(STEAROYLOXY)METHYL]ETHYL STEARATEA1PUB0.7
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
BRC12-BROMODODECANOIC ACIDA1BSO0.73
AZ1AZELAIC ACIDA,B1TUF0.8
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B3DSJ0.72
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2RCH0.72
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2VST0.72
CN6(2R,5R,11S,14R)-2-(butanoyloxy)-
5,8,11-trihydroxy-5,11-dioxido-
16-oxo-14-[(propanoyloxy)methyl]-
4,6,10,12,15-pentaoxa-5,11-diphosphanonadec-
1-yl undecanoate		A,C,D,E,L,N,
O,P,W		3CXH0.71
7PH(1R)-2-(dodecanoyloxy)-1-[(phosphonooxy)methyl]ethyl tetradecanoateA,C,D,E,L,N,
O,P,W		3CXH0.71
7PH(1R)-2-(dodecanoyloxy)-1-[(phosphonooxy)methyl]ethyl tetradecanoateA,C,D,E,L,N,
O,P,W		3CX50.71
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		3CX50.74
6ULTETRACOSYL PALMITATEA,B2H260.8
CDLCARDIOLIPINH,L,M3DTA0.7
CDLCARDIOLIPINC1E140.7
CDLCARDIOLIPINA,C,D,E,G,N,
P,Q,R,S		3H1J0.7
CDLCARDIOLIPINH,L,M2UX50.7
CDLCARDIOLIPINH,L,M3DTS0.7
CDLCARDIOLIPINH,L,M1K6N0.7
CDLCARDIOLIPINL,M1YF60.7
CDLCARDIOLIPINH,L,M2UXJ0.7
CDLCARDIOLIPINA,B,C,D,E,F,
G,N,O,P,Q,R,
S,T		1PP90.7
CDLCARDIOLIPINL,M1M3X0.7
CDLCARDIOLIPINH,L,M2HJ60.7
CDLCARDIOLIPINL,M1KBY0.7
CDLCARDIOLIPINH,L,M1RG50.7
CDLCARDIOLIPINA,C,D,E,G,P,
Q,R,W		3CWB0.7
CDLCARDIOLIPINA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z		2EIK0.7
CDLCARDIOLIPINL,M1JGY0.7
CDLCARDIOLIPINH,L,M3DTR0.7
CDLCARDIOLIPINA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z		2EIN0.7
CDLCARDIOLIPINH,L,M2J8D0.7
CDLCARDIOLIPINH,L,M1RY50.7
CDLCARDIOLIPINH,L,M1RZH0.7
CDLCARDIOLIPINH,L,M2UXK0.7
CDLCARDIOLIPINH,L,M2HH10.7
CDLCARDIOLIPINA,C,D,E,N,P,
Q,R		3H1H0.7
CDLCARDIOLIPINA,C,D,E,N,P,
Q,R		3H1K0.7
CDLCARDIOLIPINH,L,M3DU20.7
CDLCARDIOLIPINA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2DYS0.7
CDLCARDIOLIPINL,M2JJ00.7
CDLCARDIOLIPINH,L,M1RVJ0.7
CDLCARDIOLIPINL,M1JGW0.7
CDLCARDIOLIPINH,L,M1K6L0.7
CDLCARDIOLIPINH,L,M2HHK0.7
CDLCARDIOLIPINA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2DYR0.7
CDLCARDIOLIPINA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2EIM0.7
CDLCARDIOLIPINA2C3E0.7
CDLCARDIOLIPINH,L,M3DSY0.7
CDLCARDIOLIPINL,M1JGZ0.7
CDLCARDIOLIPINH,L,M2J8C0.7
CDLCARDIOLIPINH,L,M2UWU0.7
CDLCARDIOLIPINA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2EIL0.7
CDLCARDIOLIPINH,L,M2HG90.7
CDLCARDIOLIPINH,L,M2HIT0.7
CDLCARDIOLIPINH,L,M2JIY0.7
CDLCARDIOLIPINH,L,M1RQK0.7
CDLCARDIOLIPINA,B,C1KQG0.7
CDLCARDIOLIPINA,C,D,E1KB90.7
CDLCARDIOLIPINA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z		1V550.7
CDLCARDIOLIPINH,L,M2UX40.7
CDLCARDIOLIPINL,M1QOV0.7
CDLCARDIOLIPINH,L,M3DU30.7
CDLCARDIOLIPINA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z		2EIJ0.7
CDLCARDIOLIPINH,L,M2GNU0.7
CDLCARDIOLIPINL,M1OGV0.7
CDLCARDIOLIPINA,C,D,E,N,P,
Q,R		3H1I0.7
CDLCARDIOLIPINH,L,M3DUQ0.7
CDLCARDIOLIPINA,B,C,D,E,F,
G,O,P,Q,R,S,T		1PPJ0.7
CDLCARDIOLIPINH,L,M2HG30.7
CDLCARDIOLIPINH,L,M2UX30.7
CDLCARDIOLIPINA,B,C1KQF0.7
CDLCARDIOLIPINA,B,C,D,E,F,
G,I,N,O,P,Q,
R,S,T,U,V,W		2A060.7
CDLCARDIOLIPINH,L,M2UWW0.7
CDLCARDIOLIPINA1OKC0.7
CDLCARDIOLIPINA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z		1V540.7
CDLCARDIOLIPINA,C,D,E,G,J1SQP0.7
CDLCARDIOLIPINA,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z		2ZXW0.7
CDLCARDIOLIPINA,C,D,E1P840.7
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.77
4OX4-OXODECANEDIOIC ACIDA1GJP0.77
3PH1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATEA,B,C1Y5N0.7
3PH1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATEA,C,D,E1P840.7
3PH1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATEA,B,C1SIW0.7
3PH1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATEA,B,C1Q160.7
3PH1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATEA,B,C1Y5L0.7
3PH1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATEA,B,C1Y5I0.7
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.73
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.88
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C,E,F,G2ABM0.75
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y5I0.75
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y4Z0.75
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Y5N0.75
AGA(1S)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PENTANOYLOXY)METHYL]ETHYL OCTANOATE		A,B,C1Q160.75
6PH(1R)-2-(phosphonooxy)-1-[(tridecanoyloxy)methyl]ethyl pentadecanoateA,C,D,E,L,N,
O,P,W		3CX50.71
6PH(1R)-2-(phosphonooxy)-1-[(tridecanoyloxy)methyl]ethyl pentadecanoateA,C,D,E,L,N,
O,P,W		3CXH0.71
BFC(R)-3-HYDROXYTETRADECANALA2NPV0.81
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.86
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.86
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.86