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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03706536

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OLC(2R)-2,3-dihydroxypropyl (9Z)-octadec-
9-enoate		A3D4S0.91
PT5(1S)-2-{[(R)-hydroxy{[(1R,2R,3S,4R,5R,6S)-
2,3,6-trihydroxy-4,5-bis(phosphonooxy)cyclohexyl]oxy}phosphoryl]oxy}-
1-[(octadecanoyloxy)methyl]ethyl (8E,11E)-
icosa-5,8,11,14-tetraenoate		A3GPE0.75
ASY(12E)-10-oxooctadec-12-enoic acidA,B3CEE0.74
DR91-CIS-9-OCTADECANOYL-2-CIS-9-HEXADECANOYL PHOSPHATIDYL GLYCEROLA1YMT0.82
LNLALPHA-LINOLENIC ACIDA2BYO0.72
LNLALPHA-LINOLENIC ACIDA1FK60.72
P3APHOSPHATIDYLGLYCEROL-PHOSPHOGLYCEROLA1ZDU0.81
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2DYS0.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B2IRV0.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2EIL0.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z		2DYR0.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z		2EIM0.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z		1V550.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z		2EIN0.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z		2EIK0.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z		1V540.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z		2ZXW0.82
PGV(1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-
OCTADEC-11-ENOATE		A,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z		2EIJ0.82
13R13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.8
P0EPHOSPHATIDYL ETHANOLA1YOW0.8
E2PPROSTAGLANDIN B2A1CZ20.71
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B2RCL0.87
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B3DSK0.87
4HD(4S,5E,7Z,10Z,13Z,16Z,19Z)-4-hydroxydocosa-
5,7,10,13,16,19-hexaenoic acid		A,B2VV10.71
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.72
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.72
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.72
AB03,7:6,10:9,14-TRIANHYDRO-2,5,11,12,13-
PENTADEOXY-4-O-(METHOXYMETHYL)-
L-ARABINO-L-ALLO-TETRADEC-12-ENONIC ACID		H,L2E270.71
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVK0.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2DWD0.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEC2DWE0.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVJ0.74
PIE1,2-DIACYL-SN-GLYCERO-3-PHOSPHOINOSITOLA,B,C,D1UW50.77
PIE1,2-DIACYL-SN-GLYCERO-3-PHOSPHOINOSITOLA,C,D,E1KB90.77
MPG1-MONOOLEOYL-RAC-GLYCEROLA2GUF0.81
MPG1-MONOOLEOYL-RAC-GLYCEROLA,B1E120.81
11O(TRANS-12,13-EPOXY)-11-HYDROXY-
9(Z)-OCTADECENOIC ACID		A1IK31
P6L(2S)-3-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-
2-[(6E)-HEXADEC-6-ENOYLOXY]PROPYL (8E)-
OCTADEC-8-ENOATE		A1YOK0.82
9OH(TRANS-12,13-EPOXY)-9-HYDROXY-10(E)-
OCTADECENOIC ACID		A1IK30.91
LAXEICOSA-8,11,14-TRIENOIC ACIDA1FE20.74
6OB(8E,10S,12Z)-10-hydroxy-6-oxooctadeca-
8,12-dienoic acid		A,B2VV40.86
PAMPALMITOLEIC ACIDA,B,C,D1SMJ0.72
PAMPALMITOLEIC ACIDA,B,C1IZO0.72
PAMPALMITOLEIC ACIDA,B,C,D1FAG0.72
PAMPALMITOLEIC ACIDA1FK30.72
PAMPALMITOLEIC ACIDA,B3EKD0.72
PAMPALMITOLEIC ACIDA2UUH0.72
PAMPALMITOLEIC ACIDA,B1YH80.72
PAMPALMITOLEIC ACIDA,B1YHC0.72
PAMPALMITOLEIC ACIDA1UVB0.72
HO2(9E,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A3DBM0.83
VCAVACCENIC ACIDA,B2BAW0.74
VCAVACCENIC ACIDA,B2B500.74
VCAVACCENIC ACIDB2ACO0.74
VCAVACCENIC ACIDA,B2AWH0.74
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Y0.74
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Z0.74
PG2PROSTAGLANDIN D2A,B1RY00.73
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.74
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.74
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.74
PGW(1R)-2-{[(S)-{[(2S)-2,3-dihydroxypropyl]oxy}(hydroxy)phosphoryl]oxy}-
1-[(hexadecanoyloxy)methyl]ethyl (9Z)-
octadec-9-enoate		A,B,G,H2R9R0.82
13S13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.8
GGDNONADEC-10-ENOIC ACID 2-[3,4-DIHYDROXY-
6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-TETRAHYDRO-PYRAN-2-YLOXY]-
1-OCTADEC-9-ENOYLOXYMETHYL-ETHYL ESTER		H,L,M2J8C0.75
GGDNONADEC-10-ENOIC ACID 2-[3,4-DIHYDROXY-
6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-TETRAHYDRO-PYRAN-2-YLOXY]-
1-OCTADEC-9-ENOYLOXYMETHYL-ETHYL ESTER		L,M1M3X0.75
ODT(11E,13E,15Z)-OCTADECA-11,13,15-
TRIENOIC ACID		A2BAC0.7
RCLRICINOLEIC ACIDA2CM40.82
RCLRICINOLEIC ACIDA2CM90.82
RCLRICINOLEIC ACIDA1FK70.82
MRCMUPIROCINA1JZS0.77
MRCMUPIROCINA,T1FFY0.77
MRCMUPIROCINA1QU30.77
MRCMUPIROCINA,T1QU20.77
NER(15E)-TETRACOS-15-ENOIC ACIDA2EUK0.74
EICLINOLEIC ACIDA2Q9S0.74
EICLINOLEIC ACIDA2EVL0.74
EICLINOLEIC ACIDA1IGZ0.74
T24(9Z,11E,13S,15Z)-13-hydroxyoctadeca-
9,11,15-trienoic acid		A,B3DSI0.83
ELA9-OCTADECENOIC ACIDA1HMR0.74
PVC(2E,4R,5S)-2,3,4,5-TETRAHYDROXY-
6-(PALMITOYLOXY)HEX-2-ENOIC ACID		A1W3Y0.83
ODD(10E,12Z)-OCTADECA-10,12-DIENOIC ACIDA2BAB0.71
E4H(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL-
4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE		A,B2HFK0.72
9HO(9S,10E,12Z)-9-hydroxyoctadeca-
10,12-dienoic acid		A,B2VSR0.83
GMMGLUCOSE MONOMYCOLATEA1UQS0.7
5HE(5R,6E,8Z,11Z,14Z,17Z)-5-hydroxyicosa-
6,8,11,14,17-pentaenoic acid		A,B2VV20.72
13T13-DEOXYTEDANOLIDE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		2OTJ0.73
DGADIACYL GLYCEROLA,C2NLJ0.72
DGADIACYL GLYCEROLA,C1ZWI0.72
DGADIACYL GLYCEROLB,C1R3J0.72
DGADIACYL GLYCEROLC1K4D0.72
DGADIACYL GLYCEROLA,C1K4C0.72
DGADIACYL GLYCEROLC1R3K0.72
DGADIACYL GLYCEROLB,C1S5H0.72
DGADIACYL GLYCEROLC,H1R3I0.72
DGADIACYL GLYCEROLB,C1R3L0.72
OLAOLEIC ACIDA1VYF0.74
OLAOLEIC ACIDA2EV40.74
OLAOLEIC ACIDA1FK50.74
OLAOLEIC ACIDA1FE30.74
OLAOLEIC ACIDA,B2AG40.74
OLAOLEIC ACIDA,B1J780.74
OLAOLEIC ACIDA2E9L0.74
OLAOLEIC ACIDA,B2EV10.74
OLAOLEIC ACIDA1GNI0.74
OLAOLEIC ACIDA1SX60.74
OLAOLEIC ACIDA2E9M0.74
OLAOLEIC ACIDA2FLJ0.74
OLAOLEIC ACIDA2ZOX0.74
OLAOLEIC ACIDA2AF90.74
OLAOLEIC ACIDA,B,C2AG20.74
OLAOLEIC ACIDA2JU80.74
OLAOLEIC ACIDA,B1GT60.74
OLAOLEIC ACIDA,B,C1PMP0.74
OLAOLEIC ACIDA,B1DKF0.74
OLAOLEIC ACIDA1ICN0.74
OLAOLEIC ACIDA1G740.74
OLAOLEIC ACIDA,B1J7E0.74
OLAOLEIC ACIDA1LFO0.74
OLAOLEIC ACIDA1HMS0.74
OLAOLEIC ACIDA2EV30.74
OLAOLEIC ACIDA2EV20.74
OLAOLEIC ACIDA2FTB0.74
OLAOLEIC ACIDA1LID0.74
B7N(1R)-2-{[(S)-hydroxy{[(1S,2R,3R,4S,5S,6R)-
2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl]oxy}-
1-[(octadecanoyloxy)methyl]ethyl (9Z)-
octadec-9-enoate		A3B7N0.77
B7N(1R)-2-{[(S)-hydroxy{[(1S,2R,3R,4S,5S,6R)-
2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl]oxy}-
1-[(octadecanoyloxy)methyl]ethyl (9Z)-
octadec-9-enoate		A3B7Z0.77
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B3DSJ0.83
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2RCH0.83
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2VST0.83
8PG(8S,12S)-15S-HYDROXY-9-OXOPROSTA-
10Z,13E-DIEN-1-OIC ACID		A,B2G5W0.73
6OC(8R,9Z,12Z)-8-hydroxy-6-oxooctadeca-
9,12-dienoic acid		A,B2VV40.82
EAH(5S,7E,9E,11Z,14Z)-5-hydroxyicosa-
7,9,11,14-tetraenoic acid		A3DZT0.74