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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03400588

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PNEPARA-NITROPHENYL PHOSPHONOBUTANOYL L-
ALANINE
L1KN20.71
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.71
4NS4-nitrophenyl sulfateX2ZYU0.8
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.88
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.88
4NP4-NITROPHENYL PHOSPHATEA2I6P0.88
PGGPARA-NITROPHENYLPHOSPHONOBUTANOYL-
GLYCINE
L1YEI0.71
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1GAF0.82
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1AJ70.82
4NC4-NITROCATECHOLA1NO30.74
4NC4-NITROCATECHOLB2BUU0.74
4NC4-NITROCATECHOLB2BUZ0.74
4NC4-NITROCATECHOLB1EOC0.74
4NL4-AMINOPHENOLA2ORL0.7
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMP1E2S0.72
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMA1PA90.72
TNFPICRIC ACIDA1GVS0.72
TNFPICRIC ACIDX1VYP0.72
TNFPICRIC ACIDA1VYR0.72
TNFPICRIC ACIDX1VYS0.72
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.86
PDEPARA-NITROPHENYL PHOSPHONOBUTANOYL D-
ALANINE
L1KN40.71
NCR2-NITRO-P-CRESOLA,B1AHV0.7
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
PNF6-{4-[HYDROXY-(4-NITRO-PHENOXY)-
PHOSPHORYL]-BUTYRYLAMINO}-HEXANOIC ACID
L1YEJ0.72
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.88
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.77
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.89
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.89
NPOP-NITROPHENOLA,B1Z440.79
NPOP-NITROPHENOLX2ZYW0.79
NPOP-NITROPHENOLH,L1YEK0.79
NPOP-NITROPHENOLA,C,E,G43CA0.79
NPOP-NITROPHENOLA1LS60.79
NPOP-NITROPHENOLX2ZVP0.79
NPOP-NITROPHENOLA,B2I100.79
NPOP-NITROPHENOLA1VAH0.79
NPOP-NITROPHENOLA,B3ETT0.79
NPOP-NITROPHENOLA,B2D200.79
NPOP-NITROPHENOLX2ZYV0.79