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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00008880

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.79
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1GAF0.88
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1AJ70.88
DNF2,4-DINITROPHENOLA,B2B160.83
DNF2,4-DINITROPHENOLH,J,L,N1OAU0.83
DNF2,4-DINITROPHENOLA1GVO0.83
DNF2,4-DINITROPHENOLA,B2B150.83
DNF2,4-DINITROPHENOLA,B2B140.83
TNFPICRIC ACIDA1GVS0.81
TNFPICRIC ACIDX1VYP0.81
TNFPICRIC ACIDA1VYR0.81
TNFPICRIC ACIDX1VYS0.81
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.94
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.73
4NS4-nitrophenyl sulfateX2ZYU0.9
PDEPARA-NITROPHENYL PHOSPHONOBUTANOYL D-
ALANINE
L1KN40.73
DNC3,5-DINITROCATECHOLA3BWY0.76
DNC3,5-DINITROCATECHOLA3BWM0.76
DNC3,5-DINITROCATECHOLA1VID0.76
NBZNITROBENZENEA,B2BMQ0.71
NBZNITROBENZENEA,B3BGU0.71
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.79
NPOP-NITROPHENOLA,B1Z440.9
NPOP-NITROPHENOLX2ZYW0.9
NPOP-NITROPHENOLH,L1YEK0.9
NPOP-NITROPHENOLA,C,E,G43CA0.9
NPOP-NITROPHENOLA1LS60.9
NPOP-NITROPHENOLX2ZVP0.9
NPOP-NITROPHENOLA,B2I100.9
NPOP-NITROPHENOLA1VAH0.9
NPOP-NITROPHENOLA,B3ETT0.9
NPOP-NITROPHENOLA,B2D200.9
NPOP-NITROPHENOLX2ZYV0.9
NCR2-NITRO-P-CRESOLA,B1AHV0.77
PGGPARA-NITROPHENYLPHOSPHONOBUTANOYL-
GLYCINE
L1YEI0.75
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.7
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMP1E2S0.8
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMA1PA90.8
PNF6-{4-[HYDROXY-(4-NITRO-PHENOXY)-
PHOSPHORYL]-BUTYRYLAMINO}-HEXANOIC ACID
L1YEJ0.75
BPNPARANITROBENZYL ALCOHOLH,L1YEG0.71
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.97
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.97
PNEPARA-NITROPHENYL PHOSPHONOBUTANOYL L-
ALANINE
L1KN20.73
HPSPHENYL DIHYDROGEN PHOSPHATEA1O4O0.71
KHP2-HYDROXYMETHYL-5-(4-NITRO-PHENOXY)-
TETRAHYDRO-FURAN-3,4-DIOL
A,B1QW90.7
2AF2-AMINOPHENOLA1L4N0.74
4NL4-AMINOPHENOLA2ORL0.79
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.88
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q1
4NP4-NITROPHENYL PHOSPHATEA,B1VE71
4NP4-NITROPHENYL PHOSPHATEA2I6P1
4NC4-NITROCATECHOLA1NO30.83
4NC4-NITROCATECHOLB2BUU0.83
4NC4-NITROCATECHOLB2BUZ0.83
4NC4-NITROCATECHOLB1EOC0.83