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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02840438

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
15M(5Z)-7-{(1R,2R,3R,5S)-3,5-DIHYDROXY-
2-[(1E,3S)-3-HYDROXY-5-PHENYLPENT-
1-ENYL]CYCLOPENTYL}-N-ETHYLHEPT-
5-ENAMIDE
A2F380.76
24B(2,4-DIFLUOROPHENYL)METHANOLA,B1QV60.73
2PMN-[2-(BENZHYDRYLOXY)ETHYL]-N,N-
DIMETHYLAMINE
A,B2AOT0.73
4BZ4-(HYDROXYMETHYL)BENZAMIDINEA1S6H0.7
AHT4-(2,5-DIAMINO-5-HYDROXY-PENTYL)-
PHENOL
I,T1TMB0.76
44B1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2-
TRIFLUOROETHYL)AMINO]PHENYL}PROPAN-
2-OL
A,B,C,D1PQ90.71
1BHN-BENZYLOXYCARBONYL-ALA-PRO-3-AMINO-
4-PHENYL-BUTAN-2-OL
A1BH60.7
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.76
341(3,5-difluorophenyl)methanolC3EON0.72
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.71
AEF4-(2-aminoethyl)phenolA3BRA0.76
ALEL-EPINEPHRINEA3PAH0.78
ALEL-EPINEPHRINEA2HKK0.78
ALDCARBOBENZYLOXYLEUCINYL-LEUCINYL-
LEUCINAL
A1BP40.71
412(R)-1-(4-(4-(HYDROXYMETHYL)-1,3,2-
DIOXABOROLAN-2-YL)PHENETHYL)GUANIDINE
A1ZML0.71
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.72
12M(2-ETHYLPHENYL)METHANOLA,B2F620.73
ANMANISOMYCIN1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1K730.7
ANMANISOMYCIN0,1,3,9,A,B,
C,F,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z
3CC40.7
4FP4-(4-FLUOROBENZYL)PIPERIDINEA2OHN0.7
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.76
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.73