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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02495840

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SRNSORANGICIN AC,D1YNJ0.71
AURAUROVERTIN BA,B,C,D,E,F1COW0.74
TG1A,B2AGV0.77
TG1A2ZBF0.77
TG1A2ZBG0.77
TG1A,B,C,D1WPG0.77
TG1A2C8L0.77
TG1A2EAR0.77
TG1A,B1IWO0.77
TG1A2C880.77
TG1A2DQS0.77
TG1A2C8K0.77
TG1A1XP50.77
TG1A2EAT0.77
SWISWINHOLIDE AA,B1YXQ0.72
DOGDIGOXIGENINA1LKE0.81
COV(1S,3R,5Z,7E,14beta,17alpha)-17-
[(2S,4S)-4-(2-hydroxy-2-methylpropyl)-
2-methyltetrahydrofuran-2-yl]-9,10-
secoandrosta-5,7,10-triene-1,3-
diol
A3CS40.72
PIDPERIDININA2C9E0.8
PIDPERIDININM,N,O1PPR0.8
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A2RKV0.8
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A,B,C,D2ZBA0.8
DTXDIGITOXIGENINA1LNM0.8
TH2TESTOSTERONE HEMISUCCINATEA,B2CBT0.7
TH2TESTOSTERONE HEMISUCCINATEA,B,C,D,E,F2CBQ0.7
TH2TESTOSTERONE HEMISUCCINATEA2CBO0.7
RGCREIDISPONGIOLIDE CA2ASP0.72
FUGFUMAGILLINA,B3FMQ0.79
FUGFUMAGILLINA1BOA0.79
FSCFUSICOCCINA1O9E0.75
FSCFUSICOCCINA,P1O9F0.75
FSCFUSICOCCINA,B2O980.75
KH15-(2-{1-[1-(4-ETHYL-4-HYDROXY-HEXYLOXY)-
ETHYL]-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE}-ETHYLIDENE)-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A1IE80.72
FUAFUSIDIC ACIDA1QCA0.79
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q230.79
FUAFUSIDIC ACIDA,B2VUF0.79
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one
A3B2S0.72
0CO(1S,3R,5Z,7E,14beta,17alpha,23R)-
23-(2-hydroxy-2-methylpropyl)-20,24-
epoxy-9,10-secochola-5,7,10-triene-
1,3-diol
A3CS60.72
MRCMUPIROCINA1JZS0.75
MRCMUPIROCINA,T1FFY0.75
MRCMUPIROCINA1QU30.75
MRCMUPIROCINA,T1QU20.75
OBNOUABAINH,L1IBG0.74
SIMSIMVASTATINA,B,C,D1HW90.71
NEXA,B,C,D,E,F,
G,H,I,J
1RWT0.71
NEXA,B,C2BHW0.71
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A,B,E1R8Q0.8
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A1RE00.8
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A,E1S9D0.8
DGXDIGOXINB,D1IGJ0.71
PRB13-ACETYLPHORBOLA1PTR0.77