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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03378201

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.74
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)B,C,D1TYM0.88
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)B,C,D1TYL0.88
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A2OCU0.88
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A,B,C,D,F3DJI0.88
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A2DPZ0.88
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.71
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.71
NCR2-NITRO-P-CRESOLA,B1AHV0.71
2AF2-AMINOPHENOLA1L4N0.81
LI63,4-DIHYDROXY-1-METHYLQUINOLIN-
2(1H)-ONE
A1YXV0.7
2AC2-AMINO-P-CRESOLH,I1A2C0.76
2AC2-AMINO-P-CRESOLA1L4M0.76
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.71
TCC2-(2,4-DICHLORO-PHENYLAMINO)-PHENOLA,B1NHW0.74
DMC3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)-
2-METHYL-PROPIONIC ACID
G4GCH0.76
4NC4-NITROCATECHOLA1NO30.74
4NC4-NITROCATECHOLB2BUU0.74
4NC4-NITROCATECHOLB2BUZ0.74
4NC4-NITROCATECHOLB1EOC0.74
OPB4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE-
3,5-DIONE
A1Q7A0.74
OPB4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE-
3,5-DIONE
A,B2BXB0.74
OPB4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE-
3,5-DIONE
A2BXO0.74
FENN-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDEA1FEL0.76
4NL4-AMINOPHENOLA2ORL0.86
TNFPICRIC ACIDA1GVS0.72
TNFPICRIC ACIDX1VYP0.72
TNFPICRIC ACIDA1VYR0.72
TNFPICRIC ACIDX1VYS0.72
A484-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOLA,B2Q6J0.81
DNF2,4-DINITROPHENOLA,B2B160.74
DNF2,4-DINITROPHENOLH,J,L,N1OAU0.74
DNF2,4-DINITROPHENOLA1GVO0.74
DNF2,4-DINITROPHENOLA,B2B150.74
DNF2,4-DINITROPHENOLA,B2B140.74
NAFM-(N,N,N-TRIMETHYLAMMONIO)-2,2,2-
TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE
A1AMN0.79
NAFM-(N,N,N-TRIMETHYLAMMONIO)-2,2,2-
TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE
A,B2H9Y0.79
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.73
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.73
4NP4-NITROPHENYL PHOSPHATEA2I6P0.73
4NS4-nitrophenyl sulfateX2ZYU0.74
EDREDROPHONIUM IONA1AX90.9
EDREDROPHONIUM IONA2ACK0.9
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1GAF0.7
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1AJ70.7
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.74
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.74
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
N4EN-(4-ethoxyphenyl)acetamideA,B,C,D3EBS0.74
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQR0.77
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQS0.77
HPF1-[(2-HYDROXYLPHENYL)AMINO]3-GLYCEROLPHOSPHATEA,B1TJP0.75
3GV(3S)-1-(2-hydroxyphenyl)-5-oxopyrrolidine-
3-carboxylic acid
A,B3GVB0.75