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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01727594

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PBS(2S,3S,4R)-N-OCTANOYL-1-[(ALPHA-
D-GALACTOPYRANOSYL)OXY]-2-AMINO-
OCTADECANE-3,4-DIOL
A,C1Z5L0.71
ROXROXITHROMYCINA1JZZ0.9
81818-HYDROXYASCOMYCINA1FKD0.71
TAOTROLEANDOMYCIN01OND0.88
GSL(2S,3R)-3-HYDROXY-2-(TETRADECANOYLAMINO)OCTADECYL ALPHA-
D-GALACTOPYRANOSIDURONIC ACID
A2FIK0.74
JOSA2O440.8
PXI4-{[4-(DIMETHYLAMINO)-3-HYDROXY-
6-METHYLTETRAHYDRO-2H-PYRAN-2-YL]OXY}-
12-ETHYL-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2C6H0.79
PXI4-{[4-(DIMETHYLAMINO)-3-HYDROXY-
6-METHYLTETRAHYDRO-2H-PYRAN-2-YL]OXY}-
12-ETHYL-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2CA00.79
PXI4-{[4-(DIMETHYLAMINO)-3-HYDROXY-
6-METHYLTETRAHYDRO-2H-PYRAN-2-YL]OXY}-
12-ETHYL-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2CD80.79
PXI4-{[4-(DIMETHYLAMINO)-3-HYDROXY-
6-METHYLTETRAHYDRO-2H-PYRAN-2-YL]OXY}-
12-ETHYL-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2VZ70.79
TYKTYLOSIN1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1K9M0.78
CTYCLARITHROMYCINA1J5A1
ERYERYTHROMYCIN AA,B2IYF1
ERYERYTHROMYCIN AA,B3FRQ1
ERYERYTHROMYCIN A0,1,2,3,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z
1YI21
ERYERYTHROMYCIN AA,B2J0D1
ERYERYTHROMYCIN AA1JZY1
ERNA2O430.89
ZITAZITHROMYCIN01NWY0.92
ZITAZITHROMYCIN1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1M1K0.92
ZITAZITHROMYCIN0,1,3,9,A,B,
C,F,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z
1YHQ0.92
SPRSPIRAMYCIN I1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1KD10.78
ZIOA,B2IYA0.94
NRBNARBOMYCINA,B2VZM0.77
NRBNARBOMYCINA2C7X0.77
CAICARBOMYCIN A1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1K8A0.78
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE
A1ZT40.71
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE
A,C,E2PO60.71