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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02857537

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CLCN-ACETYL-P-NITROPHENYLSERINOLA1GRR0.8
TNL2,4,6-TRINITROTOLUENEA1GVR0.76
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A,B,C,D1PX00.89
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A,B,C,D2ZHM0.89
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A2ZHN0.89
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.71
CLMCHLORAMPHENICOLA1K010.74
CLMCHLORAMPHENICOL1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1NJI0.74
CLMCHLORAMPHENICOLA,B,C,D,E,F2JKL0.74
CLMCHLORAMPHENICOLA2XAT0.74
CLMCHLORAMPHENICOLA4CLA0.74
CLMCHLORAMPHENICOLA1CLA0.74
CLMCHLORAMPHENICOLA,B,C,D,E,F1USQ0.74
CLMCHLORAMPHENICOLA,B,C,D,E,F2JKJ0.74
CLMCHLORAMPHENICOLA,B2UXP0.74
CLMCHLORAMPHENICOLA1QHS0.74
CLMCHLORAMPHENICOLA1QHY0.74
CLMCHLORAMPHENICOLA3CLA0.74
RNO(R)-PARA-NITROSTYRENE OXIDEA,B,C,D1ZMT0.91
MNP2-(3-NITROPHENYL)ACETIC ACIDB1AI50.76
NTD2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE-
1,3-DIONE
A,B1T470.72
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.71
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.71
4NP4-NITROPHENYL PHOSPHATEA2I6P0.71
PNB4-NITRO-BENZYLPHOSPHONOBUTANOYL-
GLYCINE
A,L1YED0.7
PNB4-NITRO-BENZYLPHOSPHONOBUTANOYL-
GLYCINE
H,L1YEC0.7
PNB4-NITRO-BENZYLPHOSPHONOBUTANOYL-
GLYCINE
H1YEE0.7
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.75
PNZP-NITRO-BENZYLAMINEA,B2C700.75
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.73
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.72
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.72
4NB4-NITROBENZOIC ACIDA,B3CHT0.75
NPA2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACIDH1NGP0.71
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.7
NAFM-(N,N,N-TRIMETHYLAMMONIO)-2,2,2-
TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE
A1AMN0.71
NAFM-(N,N,N-TRIMETHYLAMMONIO)-2,2,2-
TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE
A,B2H9Y0.71
SOAISATOIC ANHYDRIDEA1BIO0.75
PPNPARA-NITROPHENYLALANINEI1YTJ0.72
BPNPARANITROBENZYL ALCOHOLH,L1YEG0.88
BRXBROMAMPHENICOLA,B,C,D,E,F2JKL0.76
M09(3S,5R,7R,8S,9S,10R)-7-(hydroxymethyl)-
3-(4-nitrophenyl)-1,6-dioxa-2-azaspiro[4.5]decane-
8,9,10-triol
A2QRM0.7
NPOP-NITROPHENOLA,B1Z440.71
NPOP-NITROPHENOLX2ZYW0.71
NPOP-NITROPHENOLH,L1YEK0.71
NPOP-NITROPHENOLA,C,E,G43CA0.71
NPOP-NITROPHENOLA1LS60.71
NPOP-NITROPHENOLX2ZVP0.71
NPOP-NITROPHENOLA,B2I100.71
NPOP-NITROPHENOLA1VAH0.71
NPOP-NITROPHENOLA,B3ETT0.71
NPOP-NITROPHENOLA,B2D200.71
NPOP-NITROPHENOLX2ZYV0.71
4NS4-nitrophenyl sulfateX2ZYU0.72
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.74
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.77
NCR2-NITRO-P-CRESOLA,B1AHV0.75
MAZFORMIC ACID 3-AMINO-BENZYL ESTERH,L1JYQ0.74
SNO(S)-PARA-NITROSTYRENE OXIDEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1ZO80.91
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.71
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V970.85
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V980.85
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V960.85
PRQ(3S)-3-amino-3-(2-nitrophenyl)propanoic acidC,F,I,L2VE60.71
3NT3-NITROTOLUENEA,B2BMR0.76
3NT3-NITROTOLUENEA,B2HMO0.76