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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03214616

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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
A3CS60.71
EB1SEOCALCITOLA1S0Z0.71
NEXA,B,C,D,E,F,
G,H,I,J
1RWT0.74
NEXA,B,C2BHW0.74
FSCFUSICOCCINA1O9E0.78
FSCFUSICOCCINA,P1O9F0.78
FSCFUSICOCCINA,B2O980.78
DGXDIGOXINB,D1IGJ0.72
RPARHODOPINAL GLUCOSIDEA,B,C,D,E,F1IJD0.82
OCC2ALPHA-(3-HYDROXYPROPOXY)-1ALPHA,25-
DIHYDROXYVITAMIN D3
A2HAR0.74
SXNSalinixanthinA,B3DDL0.76
XATA,B,C,D,E,F,
G,H,I,J
1RWT0.72
XATA,B,C2BHW0.72
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
A3CS40.71
FUGFUMAGILLINA,B3FMQ0.73
FUGFUMAGILLINA1BOA0.73
C3O2ALPHA-PROPOXY-1ALPHA,25-DIHYDROXYVITAMIN D3A2HAS0.74
CW1Cotylenin AA,B,C,D3E6Y0.72
RG1RHODOPIN GLUCOSIDEA,B,D,E,G,H1KZU0.82
RG1RHODOPIN GLUCOSIDEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,R,S
2FKW0.82
RG1RHODOPIN GLUCOSIDEA,B,C,D,E,F1NKZ0.82
KH15-(2-{1-[1-(4-ETHYL-4-HYDROXY-HEXYLOXY)-
ETHYL]-7A-METHYL-OCTAHYDRO-INDEN-
4-YLIDENE}-ETHYLIDENE)-4-METHYLENE-
CYCLOHEXANE-1,3-DIOL
A1IE80.71
OBNOUABAINH,L1IBG0.75