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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02525979

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
E2PPROSTAGLANDIN B2A1CZ20.94
HO2(9E,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A3DBM0.88
LNLALPHA-LINOLENIC ACIDA2BYO0.72
LNLALPHA-LINOLENIC ACIDA1FK60.72
MEI(2E,4E)-11-METHOXY-3,7,11-TRIMETHYLDODECA-
2,4-DIENOIC ACID		A,B1UHL0.71
T24(9Z,11E,13S,15Z)-13-hydroxyoctadeca-
9,11,15-trienoic acid		A,B3DSI0.86
8PG(8S,12S)-15S-HYDROXY-9-OXOPROSTA-
10Z,13E-DIEN-1-OIC ACID		A,B2G5W0.87
OCR(5E,8E,11Z,13E)-15-oxoicosa-5,8,11,13-
tetraenoic acid		A,B2ZK40.74
HEQ3-[18-(4-HYDROXY-2,6,6-TRIMETHYL-
CYCLOHEX-1-ENYL)-3,7,12,16-TETRAMETHYL-
OCTADECA-1,3,5,7,9,11,13,15, 17-
NONAENYL]-2,4,4-TRIMETHYL-CYCLOHEX-
2-ENONE		A,B1M980.7
4HD(4S,5E,7Z,10Z,13Z,16Z,19Z)-4-hydroxydocosa-
5,7,10,13,16,19-hexaenoic acid		A,B2VV10.76
13S13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.86
5HE(5R,6E,8Z,11Z,14Z,17Z)-5-hydroxyicosa-
6,8,11,14,17-pentaenoic acid		A,B2VV20.76
11O(TRANS-12,13-EPOXY)-11-HYDROXY-
9(Z)-OCTADECENOIC ACID		A1IK30.77
LAXEICOSA-8,11,14-TRIENOIC ACIDA1FE20.74
PG2PROSTAGLANDIN D2A,B1RY00.79
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
6OC(8R,9Z,12Z)-8-hydroxy-6-oxooctadeca-
9,12-dienoic acid		A,B2VV40.84
RCLRICINOLEIC ACIDA2CM40.8
RCLRICINOLEIC ACIDA2CM90.8
RCLRICINOLEIC ACIDA1FK70.8
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B3DSJ0.88
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2RCH0.88
243(9Z,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A,B2VST0.88
VCAVACCENIC ACIDA,B2BAW0.74
VCAVACCENIC ACIDA,B2B500.74
VCAVACCENIC ACIDB2ACO0.74
VCAVACCENIC ACIDA,B2AWH0.74
OCX(5E,11E,14E)-8-oxoicosa-5,9,11,14-
tetraenoic acid		A,B2ZK30.71
1642-(3-CARBOXYPROPIONYL)-6-HYDROXY-
CYCLOHEXA-2,4-DIENE CARBOXYLIC ACID		A1R6W0.76
PVC(2E,4R,5S)-2,3,4,5-TETRAHYDROXY-
6-(PALMITOYLOXY)HEX-2-ENOIC ACID		A1W3Y0.71
9HO(9S,10E,12Z)-9-hydroxyoctadeca-
10,12-dienoic acid		A,B2VSR0.88
PTG(5E,14E)-11-oxoprosta-5,9,12,14-
tetraen-1-oic acid		A,B2ZK10.73
PTG(5E,14E)-11-oxoprosta-5,9,12,14-
tetraen-1-oic acid		A2ZK20.73
OXR4-OXORETINOLA,B1X8L0.71
OLC(2R)-2,3-dihydroxypropyl (9Z)-octadec-
9-enoate		A3D4S0.76
EAH(5S,7E,9E,11Z,14Z)-5-hydroxyicosa-
7,9,11,14-tetraenoic acid		A3DZT0.77
NER(15E)-TETRACOS-15-ENOIC ACIDA2EUK0.74
EICLINOLEIC ACIDA2Q9S0.74
EICLINOLEIC ACIDA2EVL0.74
EICLINOLEIC ACIDA1IGZ0.74
ELA9-OCTADECENOIC ACIDA1HMR0.74
OPD9R,13R-12-OXOPHYTODIENOIC ACIDA,B1ICQ0.75
ODD(10E,12Z)-OCTADECA-10,12-DIENOIC ACIDA2BAB0.76
5OP(5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA-
5,13-DIEN-1-OIC ACID		A2ZB40.75
5OP(5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA-
5,13-DIEN-1-OIC ACID		A,B1V3V0.75
9OD(2Z)-9-oxodec-2-enoic acidA3BFA0.72
9OD(2Z)-9-oxodec-2-enoic acidA,B3CZ00.72
9OD(2Z)-9-oxodec-2-enoic acidA,B3CYZ0.72
9OD(2Z)-9-oxodec-2-enoic acidA3BFB0.72
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
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B2RCL0.74
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B3DSK0.74
13R13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.86
ASY(12E)-10-oxooctadec-12-enoic acidA,B3CEE0.76
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
ODT(11E,13E,15Z)-OCTADECA-11,13,15-
TRIENOIC ACID		A2BAC0.75
9OH(TRANS-12,13-EPOXY)-9-HYDROXY-10(E)-
OCTADECENOIC ACID		A1IK30.79