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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02456997

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DDIA1R4E0.72
DDIA1P960.72
AKYA,B,C,D2IPI0.79
485[2-AMINO-3-(4-HYDROXY-PHENYL)-PROPIONYLAMINO]-
(3,4,5-TRIHYDROXY-6-METHYL-TETRAHYDRO-
PYRAN-2-YL)- ACETIC ACID
A1JIL0.72
AKV{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-
4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE
A,B,C,D2F990.73
AKA10-DECARBOXYMETHYLACLACINOMYCIN A (DCMAA)A1Q0Z0.8
AKT10-DECARBOXYMETHYLACLACINOMYCIN T (DCMAT)A1Q0R0.82
BNRBIS-DAUNORUBICINB1AMD0.76
AI1N-BENZYL-3-(ALPHA-D-GALACTOS-1-
YL)-BENZAMIDE
D,E,F,G,H,L,
M,N,O,P
1FD70.72
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,B1NAB0.85
DM1DAUNOMYCINA152D0.85
DM1DAUNOMYCINA,B,C,D1O0K0.85
DM1DAUNOMYCINA1JO20.85
DM1DAUNOMYCINA,B308D0.85
DM1DAUNOMYCINA1D330.85
DM1DAUNOMYCINA110D0.85
DM1DAUNOMYCINA1D110.85
DM1DAUNOMYCINA427D0.85
DM1DAUNOMYCINA2D340.85
DM1DAUNOMYCINA3F8F0.85
DM1DAUNOMYCINA1D100.85
DM1DAUNOMYCINA1DA00.85
1137,8-DIHYDROXY-1-METHOXY-3-METHYL-
10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3-
B]CHROMENE-9-CARBOXYLIC ACID
A,B1KR30.71
1137,8-DIHYDROXY-1-METHOXY-3-METHYL-
10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3-
B]CHROMENE-9-CARBOXYLIC ACID
A,B1HLK0.71
BA1BALANOLA1BX60.73
BAD(1S)-2-amino-1-phenylethyl 6-O-
beta-L-glucopyranosyl-alpha-D-mannopyranoside
A2QJE0.7
DM36-DEOXYDAUNOMYCINA1D140.84
CMD3'-DESAMINO-3'-(3-CYANO-4-MORPHOLINYL)-
DOXORUBICIN
A236D0.77
DM2DOXORUBICINA2DR60.85
DM2DOXORUBICINA1P200.85
DM2DOXORUBICINA1I1E0.85
DM2DOXORUBICINA151D0.85
DM2DOXORUBICINA1D120.85
DM2DOXORUBICINA1DA90.85
BDA4-METHYLBENZYL-N-BIS[DAUNOMYCIN]A1AL90.77
BDA4-METHYLBENZYL-N-BIS[DAUNOMYCIN]A1AGL0.77
7CA5,7-DIHYDROXY-2-(4-METHOXYPHENYL)-
8-(3-METHYLBUTYL)-4-OXO-4H-CHROMEN-
3-YL 6-DEOXY-ALPHA-L-MANNOPYRANOSIDE
A2H440.71
CHRNEOCARZINOSTATIN-CHROMOPHOREA1O5P0.76
CHRNEOCARZINOSTATIN-CHROMOPHOREA,B1NCO0.76
CPH1,8-DIHYDROXY-7-METHYL-3-(1,3,4-
TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-
2H-ANTHRACEN-9-ONE
A,B1D830.73
CPH1,8-DIHYDROXY-7-METHYL-3-(1,3,4-
TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-
2H-ANTHRACEN-9-ONE
A,B1EKH0.73
CPH1,8-DIHYDROXY-7-METHYL-3-(1,3,4-
TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-
2H-ANTHRACEN-9-ONE
A,B1EKI0.73
CPH1,8-DIHYDROXY-7-METHYL-3-(1,3,4-
TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-
2H-ANTHRACEN-9-ONE
A,B,C,D1VAQ0.73