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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02499199

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DDIA1R4E0.72
DDIA1P960.72
7CA5,7-DIHYDROXY-2-(4-METHOXYPHENYL)-
8-(3-METHYLBUTYL)-4-OXO-4H-CHROMEN-
3-YL 6-DEOXY-ALPHA-L-MANNOPYRANOSIDE
A2H440.73
AKT10-DECARBOXYMETHYLACLACINOMYCIN T (DCMAT)A1Q0R0.94
AI1N-BENZYL-3-(ALPHA-D-GALACTOS-1-
YL)-BENZAMIDE
D,E,F,G,H,L,
M,N,O,P
1FD70.71
B8L3-[(3-SEC-BUTYL-4-HYDROXYBENZOYL)AMINO]AZEPAN-
4-YL 4-(2-HYDROXY-5-METHOXYBENZOYL)BENZOATE
A1REK0.73
BA1BALANOLA1BX60.76
AKV{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-
4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE
A,B,C,D2F990.74
BNRBIS-DAUNORUBICINB1AMD0.87
CCICALICHEAMICIN GAMMA-1-IB1QMS0.72
AKYA,B,C,D2IPI0.91
CCGCALICHEAMICIN GAMMA-1A2GKC0.7
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,B1NAB0.93
BDA4-METHYLBENZYL-N-BIS[DAUNOMYCIN]A1AL90.89
BDA4-METHYLBENZYL-N-BIS[DAUNOMYCIN]A1AGL0.89
CMD3'-DESAMINO-3'-(3-CYANO-4-MORPHOLINYL)-
DOXORUBICIN
A236D0.91
CPB2-(2-CHLORO-PHENYL)-5,7-DIHYDROXY-
8-(3-HYDROXY-1-METHYL-PIPERIDIN-
4-YL)-4H-BENZOPYRAN-4-ONE
A1E1Y0.71
CPB2-(2-CHLORO-PHENYL)-5,7-DIHYDROXY-
8-(3-HYDROXY-1-METHYL-PIPERIDIN-
4-YL)-4H-BENZOPYRAN-4-ONE
A,B3BLR0.71
CPB2-(2-CHLORO-PHENYL)-5,7-DIHYDROXY-
8-(3-HYDROXY-1-METHYL-PIPERIDIN-
4-YL)-4H-BENZOPYRAN-4-ONE
A1C8K0.71
DM2DOXORUBICINA2DR60.91
DM2DOXORUBICINA1P200.91
DM2DOXORUBICINA1I1E0.91
DM2DOXORUBICINA151D0.91
DM2DOXORUBICINA1D120.91
DM2DOXORUBICINA1DA90.91
AKA10-DECARBOXYMETHYLACLACINOMYCIN A (DCMAA)A1Q0Z0.93
CHRNEOCARZINOSTATIN-CHROMOPHOREA1O5P0.81
CHRNEOCARZINOSTATIN-CHROMOPHOREA,B1NCO0.81
DM1DAUNOMYCINA152D0.91
DM1DAUNOMYCINA,B,C,D1O0K0.91
DM1DAUNOMYCINA1JO20.91
DM1DAUNOMYCINA,B308D0.91
DM1DAUNOMYCINA1D330.91
DM1DAUNOMYCINA110D0.91
DM1DAUNOMYCINA1D110.91
DM1DAUNOMYCINA427D0.91
DM1DAUNOMYCINA2D340.91
DM1DAUNOMYCINA3F8F0.91
DM1DAUNOMYCINA1D100.91
DM1DAUNOMYCINA1DA00.91
BD23-[(4-HYDROXYBENZOYL)AMINO]AZEPAN-
4-YL 4-(2-HYDROXYBENZOYL)BENZOATE
A1RE80.71