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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03217185

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA1ZWP0.74
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA3E9X0.74
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA2OTH0.74
NCR2-NITRO-P-CRESOLA,B1AHV0.76
4NC4-NITROCATECHOLA1NO30.77
4NC4-NITROCATECHOLB2BUU0.77
4NC4-NITROCATECHOLB2BUZ0.77
4NC4-NITROCATECHOLB1EOC0.77
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.82
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.82
4NP4-NITROPHENYL PHOSPHATEA2I6P0.82
NINDINITROPHENYLENEA1RSM0.72
NINDINITROPHENYLENEA1GVY0.72
NINDINITROPHENYLENEA1GW10.72
DNC3,5-DINITROCATECHOLA3BWY0.81
DNC3,5-DINITROCATECHOLA3BWM0.81
DNC3,5-DINITROCATECHOLA1VID0.81
2AC2-AMINO-P-CRESOLH,I1A2C0.71
2AC2-AMINO-P-CRESOLA1L4M0.71
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.8
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.8
4NL4-AMINOPHENOLA2ORL0.78
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.8
DNF2,4-DINITROPHENOLA,B2B160.89
DNF2,4-DINITROPHENOLH,J,L,N1OAU0.89
DNF2,4-DINITROPHENOLA1GVO0.89
DNF2,4-DINITROPHENOLA,B2B150.89
DNF2,4-DINITROPHENOLA,B2B140.89
NIT4-NITROANILINEC,D1RMH0.7
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.7
NIT4-NITROANILINEB1VBS0.7
NIT4-NITROANILINEC1V9T0.7
NIT4-NITROANILINEC,D1VBT0.7
NIT4-NITROANILINEB1LOP0.7
NIT4-NITROANILINEC,D1ZKF0.7
NIT4-NITROANILINEB1PIP0.7
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.74
2AF2-AMINOPHENOLA1L4N0.78
NPOP-NITROPHENOLA,B1Z440.83
NPOP-NITROPHENOLX2ZYW0.83
NPOP-NITROPHENOLH,L1YEK0.83
NPOP-NITROPHENOLA,C,E,G43CA0.83
NPOP-NITROPHENOLA1LS60.83
NPOP-NITROPHENOLX2ZVP0.83
NPOP-NITROPHENOLA,B2I100.83
NPOP-NITROPHENOLA1VAH0.83
NPOP-NITROPHENOLA,B3ETT0.83
NPOP-NITROPHENOLA,B2D200.83
NPOP-NITROPHENOLX2ZYV0.83
4NS4-nitrophenyl sulfateX2ZYU0.89
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1GAF0.73
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1AJ70.73
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.75
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMP1E2S0.79
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMA1PA90.79
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.76