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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02462095

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AKT10-DECARBOXYMETHYLACLACINOMYCIN T (DCMAT)A1Q0R0.87
DM41-O-DEMETHYL-6-DEOXYDOXORUBICINA1D370.92
BNRBIS-DAUNORUBICINB1AMD0.83
AKV{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-
4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE
A,B,C,D2F990.72
DM2DOXORUBICINA2DR60.94
DM2DOXORUBICINA1P200.94
DM2DOXORUBICINA1I1E0.94
DM2DOXORUBICINA151D0.94
DM2DOXORUBICINA1D120.94
DM2DOXORUBICINA1DA90.94
DM64'-EPIDOXORUBICINA1D150.94
DM64'-EPIDOXORUBICINA1D540.94
DM64'-EPIDOXORUBICINA1D580.94
DM64'-EPIDOXORUBICINA1QDA0.94
DM36-DEOXYDAUNOMYCINA1D140.94
CHRNEOCARZINOSTATIN-CHROMOPHOREA1O5P0.77
CHRNEOCARZINOSTATIN-CHROMOPHOREA,B1NCO0.77
DM1DAUNOMYCINA152D0.94
DM1DAUNOMYCINA,B,C,D1O0K0.94
DM1DAUNOMYCINA1JO20.94
DM1DAUNOMYCINA,B308D0.94
DM1DAUNOMYCINA1D330.94
DM1DAUNOMYCINA110D0.94
DM1DAUNOMYCINA1D110.94
DM1DAUNOMYCINA427D0.94
DM1DAUNOMYCINA2D340.94
DM1DAUNOMYCINA3F8F0.94
DM1DAUNOMYCINA1D100.94
DM1DAUNOMYCINA1DA00.94
CCGCALICHEAMICIN GAMMA-1A2GKC0.72
CMD3'-DESAMINO-3'-(3-CYANO-4-MORPHOLINYL)-
DOXORUBICIN
A236D0.86
DH2(2S,3S)-2-(3,4-DIHYDROXYPHENYL)-
3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-
CHROMEN-4-ONE
A1GP50.7
DH2(2S,3S)-2-(3,4-DIHYDROXYPHENYL)-
3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-
CHROMEN-4-ONE
A1GP60.7
DM5IDARUBICINA,B,D198D0.92
DM5IDARUBICINA1D380.92
DM5IDARUBICINA1D670.92
7CA5,7-DIHYDROXY-2-(4-METHOXYPHENYL)-
8-(3-METHYLBUTYL)-4-OXO-4H-CHROMEN-
3-YL 6-DEOXY-ALPHA-L-MANNOPYRANOSIDE
A2H440.76
2HI(2S,3R)-2,7-DIHYDROXY-3-(4-HYDROXYPHENYL)-
2,3-DIHYDRO-4H-CHROMEN-4-ONE
A1ZG30.7
AKYA,B,C,D2IPI0.84
AKA10-DECARBOXYMETHYLACLACINOMYCIN A (DCMAA)A1Q0Z0.85
44D7-[5-(4-AMINO-5-HYDROXY-6-METHYL-
TETRAHYDRO-PYRAN-2-YLOXY)-4-HYDROXY-
6-METHYL-TETRAHYDRO-PYRAN-2-YLOXY]-
6,9,11-TRIHYDROXY-9-(2-HYDROXY-
ACETYL)-7,8,9,10-TETRAHYDRO-NAPHTHACENE-
5,12-DIONE
A,B1NAB0.91
BDA4-METHYLBENZYL-N-BIS[DAUNOMYCIN]A1AL90.86
BDA4-METHYLBENZYL-N-BIS[DAUNOMYCIN]A1AGL0.86
CCICALICHEAMICIN GAMMA-1-IB1QMS0.75