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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02350038

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PPNPARA-NITROPHENYLALANINEI1YTJ0.71
CLMCHLORAMPHENICOLA1K010.73
CLMCHLORAMPHENICOL1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1NJI0.73
CLMCHLORAMPHENICOLA,B,C,D,E,F2JKL0.73
CLMCHLORAMPHENICOLA2XAT0.73
CLMCHLORAMPHENICOLA4CLA0.73
CLMCHLORAMPHENICOLA1CLA0.73
CLMCHLORAMPHENICOLA,B,C,D,E,F1USQ0.73
CLMCHLORAMPHENICOLA,B,C,D,E,F2JKJ0.73
CLMCHLORAMPHENICOLA,B2UXP0.73
CLMCHLORAMPHENICOLA1QHS0.73
CLMCHLORAMPHENICOLA1QHY0.73
CLMCHLORAMPHENICOLA3CLA0.73
MAZFORMIC ACID 3-AMINO-BENZYL ESTERH,L1JYQ0.71
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.72
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.71
NPOP-NITROPHENOLA,B1Z440.75
NPOP-NITROPHENOLX2ZYW0.75
NPOP-NITROPHENOLH,L1YEK0.75
NPOP-NITROPHENOLA,C,E,G43CA0.75
NPOP-NITROPHENOLA1LS60.75
NPOP-NITROPHENOLX2ZVP0.75
NPOP-NITROPHENOLA,B2I100.75
NPOP-NITROPHENOLA1VAH0.75
NPOP-NITROPHENOLA,B3ETT0.75
NPOP-NITROPHENOLA,B2D200.75
NPOP-NITROPHENOLX2ZYV0.75
SOAISATOIC ANHYDRIDEA1BIO0.8
M09(3S,5R,7R,8S,9S,10R)-7-(hydroxymethyl)-
3-(4-nitrophenyl)-1,6-dioxa-2-azaspiro[4.5]decane-
8,9,10-triol
A2QRM0.71
3NT3-NITROTOLUENEA,B2BMR0.72
3NT3-NITROTOLUENEA,B2HMO0.72
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V970.82
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V980.82
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V960.82
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.71
BRXBROMAMPHENICOLA,B,C,D,E,F2JKL0.75
1JZ1-[4-(hydroxymethyl)phenyl]guanidineB3FVF0.7
NAFM-(N,N,N-TRIMETHYLAMMONIO)-2,2,2-
TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE
A1AMN0.73
NAFM-(N,N,N-TRIMETHYLAMMONIO)-2,2,2-
TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE
A,B2H9Y0.73
RNO(R)-PARA-NITROSTYRENE OXIDEA,B,C,D1ZMT0.84
NTD2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE-
1,3-DIONE
A,B1T470.76
NCR2-NITRO-P-CRESOLA,B1AHV0.77
NPA2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACIDH1NGP0.71
BRS2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6-
DINITRO-PHENOL
A,B,D,M,N,O,P1KFY0.73
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A,B,C,D1PX00.9
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A,B,C,D2ZHM0.9
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A2ZHN0.9
4NB4-NITROBENZOIC ACIDA,B3CHT0.74
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.71
PNZP-NITRO-BENZYLAMINEA,B2C700.71
SNO(S)-PARA-NITROSTYRENE OXIDEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1ZO80.84
HNT[(3R)-7-NITRO-1,2,3,4-TETRAHYDROISOQUINOLIN-
3-YL]METHANOL
A,B2G700.72
MNP2-(3-NITROPHENYL)ACETIC ACIDB1AI50.74
CLCN-ACETYL-P-NITROPHENYLSERINOLA1GRR0.78
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.78
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.74
BPNPARANITROBENZYL ALCOHOLH,L1YEG0.9