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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03399028

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
EPA5,8,11,14,17-EICOSAPENTAENOIC ACIDA1IGX0.83
EPA5,8,11,14,17-EICOSAPENTAENOIC ACIDA,B3GWX0.83
PAMPALMITOLEIC ACIDA,B,C,D1SMJ0.75
PAMPALMITOLEIC ACIDA,B,C1IZO0.75
PAMPALMITOLEIC ACIDA,B,C,D1FAG0.75
PAMPALMITOLEIC ACIDA1FK30.75
PAMPALMITOLEIC ACIDA,B3EKD0.75
PAMPALMITOLEIC ACIDA2UUH0.75
PAMPALMITOLEIC ACIDA,B1YH80.75
PAMPALMITOLEIC ACIDA,B1YHC0.75
PAMPALMITOLEIC ACIDA1UVB0.75
LNLALPHA-LINOLENIC ACIDA2BYO0.75
LNLALPHA-LINOLENIC ACIDA1FK60.75
OCX(5E,11E,14E)-8-oxoicosa-5,9,11,14-
tetraenoic acid		A,B2ZK30.74
LAXEICOSA-8,11,14-TRIENOIC ACIDA1FE20.74
VCAVACCENIC ACIDA,B2BAW0.74
VCAVACCENIC ACIDA,B2B500.74
VCAVACCENIC ACIDB2ACO0.74
VCAVACCENIC ACIDA,B2AWH0.74
ODT(11E,13E,15Z)-OCTADECA-11,13,15-
TRIENOIC ACID		A2BAC0.72
HXADOCOSA-4,7,10,13,16,19-HEXAENOIC ACIDA1MV90.82
HXADOCOSA-4,7,10,13,16,19-HEXAENOIC ACIDA,B1FDQ0.82
HXADOCOSA-4,7,10,13,16,19-HEXAENOIC ACIDA2BYO0.82
HXADOCOSA-4,7,10,13,16,19-HEXAENOIC ACIDA,B2G7Z0.82
LIK3,6-BIS(METHYLENE)DECANOIC ACIDA2HLV0.76
F22(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-
4,7,10,13,16,19-hexaenoic acid		A,B2VV00.82
ACDARACHIDONIC ACIDA1DIY0.83
ACDARACHIDONIC ACIDA1VYG0.83
ACDARACHIDONIC ACIDA1U670.83
ACDARACHIDONIC ACIDA1GNJ0.83
ACDARACHIDONIC ACIDA1ADL0.83
ACDARACHIDONIC ACIDA,B1CVU0.83
4R8(6E,10Z,13Z,16Z,19Z)-4-oxodocosa-
6,10,13,16,19-pentaenoic acid		A2VV30.74
OCR(5E,8E,11Z,13E)-15-oxoicosa-5,8,11,13-
tetraenoic acid		A,B2ZK40.71
NER(15E)-TETRACOS-15-ENOIC ACIDA2EUK0.74
EICLINOLEIC ACIDA2Q9S0.74
EICLINOLEIC ACIDA2EVL0.74
EICLINOLEIC ACIDA1IGZ0.74
ELA9-OCTADECENOIC ACIDA1HMR0.74
ODD(10E,12Z)-OCTADECA-10,12-DIENOIC ACIDA2BAB0.71
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
ASY(12E)-10-oxooctadec-12-enoic acidA,B3CEE0.71