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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00007037

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.71
EDREDROPHONIUM IONA1AX90.73
EDREDROPHONIUM IONA2ACK0.73
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)B,C,D1TYM0.79
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)B,C,D1TYL0.79
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A2OCU0.79
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A,B,C,D,F3DJI0.79
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A2DPZ0.79
4NL4-AMINOPHENOLA2ORL0.91
TCC2-(2,4-DICHLORO-PHENYLAMINO)-PHENOLA,B1NHW0.74
4NC4-NITROCATECHOLA1NO30.74
4NC4-NITROCATECHOLB2BUU0.74
4NC4-NITROCATECHOLB2BUZ0.74
4NC4-NITROCATECHOLB1EOC0.74
DNF2,4-DINITROPHENOLA,B2B160.87
DNF2,4-DINITROPHENOLH,J,L,N1OAU0.87
DNF2,4-DINITROPHENOLA1GVO0.87
DNF2,4-DINITROPHENOLA,B2B150.87
DNF2,4-DINITROPHENOLA,B2B140.87
TY23-AMINO-L-TYROSINEA,B2VH30.74
DNC3,5-DINITROCATECHOLA3BWY0.79
DNC3,5-DINITROCATECHOLA3BWM0.79
DNC3,5-DINITROCATECHOLA1VID0.79
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.72
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.72
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.73
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.73
4NP4-NITROPHENYL PHOSPHATEA2I6P0.73
4NS4-nitrophenyl sulfateX2ZYU0.74
HPF1-[(2-HYDROXYLPHENYL)AMINO]3-GLYCEROLPHOSPHATEA,B1TJP0.72
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.78
AZY3-AZIDO-L-TYROSINEA2YXN0.73
TNFPICRIC ACIDA1GVS0.84
TNFPICRIC ACIDX1VYP0.84
TNFPICRIC ACIDA1VYR0.84
TNFPICRIC ACIDX1VYS0.84
SOAISATOIC ANHYDRIDEA1BIO0.72
NPOP-NITROPHENOLA,B1Z440.81
NPOP-NITROPHENOLX2ZYW0.81
NPOP-NITROPHENOLH,L1YEK0.81
NPOP-NITROPHENOLA,C,E,G43CA0.81
NPOP-NITROPHENOLA1LS60.81
NPOP-NITROPHENOLX2ZVP0.81
NPOP-NITROPHENOLA,B2I100.81
NPOP-NITROPHENOLA1VAH0.81
NPOP-NITROPHENOLA,B3ETT0.81
NPOP-NITROPHENOLA,B2D200.81
NPOP-NITROPHENOLX2ZYV0.81
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMP1E2S0.71
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMA1PA90.71
2AF2-AMINOPHENOLA1L4N0.93
2AC2-AMINO-P-CRESOLH,I1A2C0.86
2AC2-AMINO-P-CRESOLA1L4M0.86
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.74
NCR2-NITRO-P-CRESOLA,B1AHV0.75