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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02376154

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4NB4-NITROBENZOIC ACIDA,B3CHT0.8
TNL2,4,6-TRINITROTOLUENEA1GVR0.71
MAZFORMIC ACID 3-AMINO-BENZYL ESTERH,L1JYQ0.71
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.72
PNZP-NITRO-BENZYLAMINEA,B2C700.72
4NC4-NITROCATECHOLA1NO30.72
4NC4-NITROCATECHOLB2BUU0.72
4NC4-NITROCATECHOLB2BUZ0.72
4NC4-NITROCATECHOLB1EOC0.72
BPNPARANITROBENZYL ALCOHOLH,L1YEG0.97
MNP2-(3-NITROPHENYL)ACETIC ACIDB1AI50.76
3NT3-NITROTOLUENEA,B2BMR0.75
3NT3-NITROTOLUENEA,B2HMO0.75
NTD2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE-
1,3-DIONE
A,B1T470.72
MNB5-MERCAPTO-2-NITRO-BENZOIC ACIDA1F420.7
MNB5-MERCAPTO-2-NITRO-BENZOIC ACIDA1RXE0.7
MNB5-MERCAPTO-2-NITRO-BENZOIC ACIDA2PER0.7
1JZ1-[4-(hydroxymethyl)phenyl]guanidineB3FVF0.72
CLCN-ACETYL-P-NITROPHENYLSERINOLA1GRR0.76
4NS4-nitrophenyl sulfateX2ZYU0.71
SOAISATOIC ANHYDRIDEA1BIO0.81
CLMCHLORAMPHENICOLA1K010.72
CLMCHLORAMPHENICOL1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1NJI0.72
CLMCHLORAMPHENICOLA,B,C,D,E,F2JKL0.72
CLMCHLORAMPHENICOLA2XAT0.72
CLMCHLORAMPHENICOLA4CLA0.72
CLMCHLORAMPHENICOLA1CLA0.72
CLMCHLORAMPHENICOLA,B,C,D,E,F1USQ0.72
CLMCHLORAMPHENICOLA,B,C,D,E,F2JKJ0.72
CLMCHLORAMPHENICOLA,B2UXP0.72
CLMCHLORAMPHENICOLA1QHS0.72
CLMCHLORAMPHENICOLA1QHY0.72
CLMCHLORAMPHENICOLA3CLA0.72
BRXBROMAMPHENICOLA,B,C,D,E,F2JKL0.73
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.73
RNO(R)-PARA-NITROSTYRENE OXIDEA,B,C,D1ZMT0.84
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V970.77
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V980.77
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V960.77
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.7
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.72
NPA2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACIDH1NGP0.71
NCR2-NITRO-P-CRESOLA,B1AHV0.78
SNO(S)-PARA-NITROSTYRENE OXIDEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1ZO80.84
IOB3-IODO-BENZYL ALCOHOLA,B1QK00.7
NPOP-NITROPHENOLA,B1Z440.76
NPOP-NITROPHENOLX2ZYW0.76
NPOP-NITROPHENOLH,L1YEK0.76
NPOP-NITROPHENOLA,C,E,G43CA0.76
NPOP-NITROPHENOLA1LS60.76
NPOP-NITROPHENOLX2ZVP0.76
NPOP-NITROPHENOLA,B2I100.76
NPOP-NITROPHENOLA1VAH0.76
NPOP-NITROPHENOLA,B3ETT0.76
NPOP-NITROPHENOLA,B2D200.76
NPOP-NITROPHENOLX2ZYV0.76
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A,B,C,D1PX00.88
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A,B,C,D2ZHM0.88
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A2ZHN0.88
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.77
PAB4-AMINOBENZOIC ACIDA1PBD0.72
PAB4-AMINOBENZOIC ACIDB2DZA0.72
PAB4-AMINOBENZOIC ACIDA1IUS0.72
PAB4-AMINOBENZOIC ACIDA1IUU0.72
PAB4-AMINOBENZOIC ACIDA1IUT0.72