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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03320264

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
8PG(8S,12S)-15S-HYDROXY-9-OXOPROSTA-
10Z,13E-DIEN-1-OIC ACID		A,B2G5W0.79
9HO(9S,10E,12Z)-9-hydroxyoctadeca-
10,12-dienoic acid		A,B2VSR0.72
OPD9R,13R-12-OXOPHYTODIENOIC ACIDA,B1ICQ0.88
LIK3,6-BIS(METHYLENE)DECANOIC ACIDA2HLV0.72
1NB2-(2-HYDROXY-CYCLOPENTYL)-PENT-
4-ENAL		P1BRU0.72
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
OLC(2R)-2,3-dihydroxypropyl (9Z)-octadec-
9-enoate		A3D4S0.7
ACDARACHIDONIC ACIDA1DIY0.74
ACDARACHIDONIC ACIDA1VYG0.74
ACDARACHIDONIC ACIDA1U670.74
ACDARACHIDONIC ACIDA1GNJ0.74
ACDARACHIDONIC ACIDA1ADL0.74
ACDARACHIDONIC ACIDA,B1CVU0.74
PGX7-[6-(3-HYDROPEROXY-OCT-1-ENYL)-
2,3-DIOXA-BICYCLO[2.2.1]HEPT-5-
YL]-HEPT-5-ENOIC ACID		A,B,C,D1DDX0.71
E4H(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL-
4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE		A,B2HFK0.71
EPA5,8,11,14,17-EICOSAPENTAENOIC ACIDA1IGX0.71
EPA5,8,11,14,17-EICOSAPENTAENOIC ACIDA,B3GWX0.71
RCLRICINOLEIC ACIDA2CM40.77
RCLRICINOLEIC ACIDA2CM90.77
RCLRICINOLEIC ACIDA1FK70.77
ODT(11E,13E,15Z)-OCTADECA-11,13,15-
TRIENOIC ACID		A2BAC0.8
LAXEICOSA-8,11,14-TRIENOIC ACIDA1FE20.84
13S13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.72
VCAVACCENIC ACIDA,B2BAW0.84
VCAVACCENIC ACIDA,B2B500.84
VCAVACCENIC ACIDB2ACO0.84
VCAVACCENIC ACIDA,B2AWH0.84
4R8(6E,10Z,13Z,16Z,19Z)-4-oxodocosa-
6,10,13,16,19-pentaenoic acid		A2VV30.73
DL7(5beta,14beta,17alpha,25R)-3-oxocholest-
7-en-26-oic acid		A3GYU0.73
1PL(1S,3aS,5aR,8aS)-1,7,7-trimethyl-
1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene-
4-carboxylic acid		A2RDS0.7
1PL(1S,3aS,5aR,8aS)-1,7,7-trimethyl-
1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene-
4-carboxylic acid		A2RDN0.7
ASY(12E)-10-oxooctadec-12-enoic acidA,B3CEE0.82
PTG(5E,14E)-11-oxoprosta-5,9,12,14-
tetraen-1-oic acid		A,B2ZK10.74
PTG(5E,14E)-11-oxoprosta-5,9,12,14-
tetraen-1-oic acid		A2ZK20.74
PAMPALMITOLEIC ACIDA,B,C,D1SMJ0.83
PAMPALMITOLEIC ACIDA,B,C1IZO0.83
PAMPALMITOLEIC ACIDA,B,C,D1FAG0.83
PAMPALMITOLEIC ACIDA1FK30.83
PAMPALMITOLEIC ACIDA,B3EKD0.83
PAMPALMITOLEIC ACIDA2UUH0.83
PAMPALMITOLEIC ACIDA,B1YH80.83
PAMPALMITOLEIC ACIDA,B1YHC0.83
PAMPALMITOLEIC ACIDA1UVB0.83
5OP(5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA-
5,13-DIEN-1-OIC ACID		A2ZB40.72
5OP(5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA-
5,13-DIEN-1-OIC ACID		A,B1V3V0.72
HO2(9E,11E,13S)-13-hydroxyoctadeca-
9,11-dienoic acid		A3DBM0.72
PG2PROSTAGLANDIN D2A,B1RY00.74
ODD(10E,12Z)-OCTADECA-10,12-DIENOIC ACIDA2BAB0.82
LNLALPHA-LINOLENIC ACIDA2BYO0.83
LNLALPHA-LINOLENIC ACIDA1FK60.83
EICLINOLEIC ACIDA2Q9S0.84
EICLINOLEIC ACIDA2EVL0.84
EICLINOLEIC ACIDA1IGZ0.84
NER(15E)-TETRACOS-15-ENOIC ACIDA2EUK0.84
ELA9-OCTADECENOIC ACIDA1HMR0.84
13R13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACIDA1IK30.72
DL4(14beta,17alpha,25R)-3-oxocholest-
4-en-26-oic acid		A3GYT0.71
OLAOLEIC ACIDA1VYF0.84
OLAOLEIC ACIDA2EV40.84
OLAOLEIC ACIDA1FK50.84
OLAOLEIC ACIDA1FE30.84
OLAOLEIC ACIDA,B2AG40.84
OLAOLEIC ACIDA,B1J780.84
OLAOLEIC ACIDA2E9L0.84
OLAOLEIC ACIDA,B2EV10.84
OLAOLEIC ACIDA1GNI0.84
OLAOLEIC ACIDA1SX60.84
OLAOLEIC ACIDA2E9M0.84
OLAOLEIC ACIDA2FLJ0.84
OLAOLEIC ACIDA2ZOX0.84
OLAOLEIC ACIDA2AF90.84
OLAOLEIC ACIDA,B,C2AG20.84
OLAOLEIC ACIDA2JU80.84
OLAOLEIC ACIDA,B1GT60.84
OLAOLEIC ACIDA,B,C1PMP0.84
OLAOLEIC ACIDA,B1DKF0.84
OLAOLEIC ACIDA1ICN0.84
OLAOLEIC ACIDA1G740.84
OLAOLEIC ACIDA,B1J7E0.84
OLAOLEIC ACIDA1LFO0.84
OLAOLEIC ACIDA1HMS0.84
OLAOLEIC ACIDA2EV30.84
OLAOLEIC ACIDA2EV20.84
OLAOLEIC ACIDA2FTB0.84
OLAOLEIC ACIDA1LID0.84
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B2RCL0.73
T25(9Z)-11-[(2R,3S)-3-pentyloxiran-
2-yl]undec-9-enoic acid		A,B3DSK0.73