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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03408187

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.87
PNEPARA-NITROPHENYL PHOSPHONOBUTANOYL L-
ALANINE
L1KN20.71
NCR2-NITRO-P-CRESOLA,B1AHV0.71
4NC4-NITROCATECHOLA1NO30.75
4NC4-NITROCATECHOLB2BUU0.75
4NC4-NITROCATECHOLB2BUZ0.75
4NC4-NITROCATECHOLB1EOC0.75
PGGPARA-NITROPHENYLPHOSPHONOBUTANOYL-
GLYCINE
L1YEI0.71
PNF6-{4-[HYDROXY-(4-NITRO-PHENOXY)-
PHOSPHORYL]-BUTYRYLAMINO}-HEXANOIC ACID
L1YEJ0.71
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1GAF0.82
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1AJ70.82
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.9
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.9
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMP1E2S0.72
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMA1PA90.72
4NS4-nitrophenyl sulfateX2ZYU0.81
NPOP-NITROPHENOLA,B1Z440.8
NPOP-NITROPHENOLX2ZYW0.8
NPOP-NITROPHENOLH,L1YEK0.8
NPOP-NITROPHENOLA,C,E,G43CA0.8
NPOP-NITROPHENOLA1LS60.8
NPOP-NITROPHENOLX2ZVP0.8
NPOP-NITROPHENOLA,B2I100.8
NPOP-NITROPHENOLA1VAH0.8
NPOP-NITROPHENOLA,B3ETT0.8
NPOP-NITROPHENOLA,B2D200.8
NPOP-NITROPHENOLX2ZYV0.8
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.72
PDEPARA-NITROPHENYL PHOSPHONOBUTANOYL D-
ALANINE
L1KN40.71
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.89
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.89
4NP4-NITROPHENYL PHOSPHATEA2I6P0.89
DNF2,4-DINITROPHENOLA,B2B160.75
DNF2,4-DINITROPHENOLH,J,L,N1OAU0.75
DNF2,4-DINITROPHENOLA1GVO0.75
DNF2,4-DINITROPHENOLA,B2B150.75
DNF2,4-DINITROPHENOLA,B2B140.75
TNFPICRIC ACIDA1GVS0.73
TNFPICRIC ACIDX1VYP0.73
TNFPICRIC ACIDA1VYR0.73
TNFPICRIC ACIDX1VYS0.73
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.87
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.77
4NL4-AMINOPHENOLA2ORL0.71