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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02424467

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A2RKV0.98
ZBA12,13-Epoxytrichothec-9-ene-3,4,8,15-
tetrol-4,15-diacetate-8-isovalerate
A,B,C,D2ZBA0.98
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one
A3B2S0.81
MRCMUPIROCINA1JZS0.8
MRCMUPIROCINA,T1FFY0.8
MRCMUPIROCINA1QU30.8
MRCMUPIROCINA,T1QU20.8
FSCFUSICOCCINA1O9E0.79
FSCFUSICOCCINA,P1O9F0.79
FSCFUSICOCCINA,B2O980.79
AURAUROVERTIN BA,B,C,D,E,F1COW0.77
OBNOUABAINH,L1IBG0.77
PIDPERIDININA2C9E0.76
PIDPERIDININM,N,O1PPR0.76
FUAFUSIDIC ACIDA1QCA0.75
FUAFUSIDIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q230.75
FUAFUSIDIC ACIDA,B2VUF0.75
FUGFUMAGILLINA,B3FMQ0.75
FUGFUMAGILLINA1BOA0.75
DTXDIGITOXIGENINA1LNM0.75
SRNSORANGICIN AC,D1YNJ0.75
DOGDIGOXIGENINA1LKE0.75
DGXDIGOXINB,D1IGJ0.74
WINmethyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)-
15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}-
3,11,12-trihydroxy-2,16-dioxo-13,20-
epoxypicras-3-en-21-oate
0,1,2,3,9,A,
B,C,F,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z
3G710.74
NEXA,B,C,D,E,F,
G,H,I,J
1RWT0.73
NEXA,B,C2BHW0.73
SXNSalinixanthinA,B3DDL0.73
TG1A,B2AGV0.72
TG1A2ZBF0.72
TG1A2ZBG0.72
TG1A,B,C,D1WPG0.72
TG1A2C8L0.72
TG1A2EAR0.72
TG1A,B1IWO0.72
TG1A2C880.72
TG1A2DQS0.72
TG1A2C8K0.72
TG1A1XP50.72
TG1A2EAT0.72
CW1Cotylenin AA,B,C,D3E6Y0.72
PRB13-ACETYLPHORBOLA1PTR0.72
C3O2ALPHA-PROPOXY-1ALPHA,25-DIHYDROXYVITAMIN D3A2HAS0.71
OKAOKADAIC ACIDA1JK70.71
OKAOKADAIC ACIDC2IE40.71
OKAOKADAIC ACIDA1U320.71
OCC2ALPHA-(3-HYDROXYPROPOXY)-1ALPHA,25-
DIHYDROXYVITAMIN D3
A2HAR0.71
XATA,B,C,D,E,F,
G,H,I,J
1RWT0.71
XATA,B,C2BHW0.71
FOKFORSKOLINA,C3C160.7
FOKFORSKOLINA,C1CJU0.7
FOKFORSKOLINA,C1TL70.7
FOKFORSKOLINA,B1AB80.7
FOKFORSKOLINA,C3C140.7
FOKFORSKOLINA,C1CJT0.7
FOKFORSKOLINA,B,C1CUL0.7
FOKFORSKOLINA,C1CJV0.7
FOKFORSKOLINA,C3C150.7
FOKFORSKOLINA,C1U0H0.7
FOKFORSKOLINA,B,C1CS40.7
FOKFORSKOLINA,C1CJK0.7
13T13-DEOXYTEDANOLIDE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z
2OTJ0.7