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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01075447

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CLKALPHA-N-DICHLOROACETYL-P-AMINOPHENYLSERINOLA1GRQ0.74
PPNPARA-NITROPHENYLALANINEI1YTJ0.76
NIYMETA-NITRO-TYROSINEA2ADP0.74
NIYMETA-NITRO-TYROSINEA3DIV0.74
NIYMETA-NITRO-TYROSINEA2H5U0.74
NIYMETA-NITRO-TYROSINEA1K4Q0.74
NIYMETA-NITRO-TYROSINEB,G,O,Y1SDA0.74
PIR2-(4-AMINO-PHENYL)-5-HYDROXYMETHYL-
PYRROLIDINE-3,4-DIOL
A,B,C,D2MAS0.72
BPNPARANITROBENZYL ALCOHOLH,L1YEG0.78
CL8CHLORAMPHENICOL SUCCINATEA,B,C,D,E,F2JKN0.75
MNP2-(3-NITROPHENYL)ACETIC ACIDB1AI50.71
4NB4-NITROBENZOIC ACIDA,B3CHT0.71
RNO(R)-PARA-NITROSTYRENE OXIDEA,B,C,D1ZMT0.73
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.71
SNO(S)-PARA-NITROSTYRENE OXIDEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1ZO80.73
CLMCHLORAMPHENICOLA1K010.8
CLMCHLORAMPHENICOL1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1NJI0.8
CLMCHLORAMPHENICOLA,B,C,D,E,F2JKL0.8
CLMCHLORAMPHENICOLA2XAT0.8
CLMCHLORAMPHENICOLA4CLA0.8
CLMCHLORAMPHENICOLA1CLA0.8
CLMCHLORAMPHENICOLA,B,C,D,E,F1USQ0.8
CLMCHLORAMPHENICOLA,B,C,D,E,F2JKJ0.8
CLMCHLORAMPHENICOLA,B2UXP0.8
CLMCHLORAMPHENICOLA1QHS0.8
CLMCHLORAMPHENICOLA1QHY0.8
CLMCHLORAMPHENICOLA3CLA0.8
M09(3S,5R,7R,8S,9S,10R)-7-(hydroxymethyl)-
3-(4-nitrophenyl)-1,6-dioxa-2-azaspiro[4.5]decane-
8,9,10-triol
A2QRM0.75
44B1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2-
TRIFLUOROETHYL)AMINO]PHENYL}PROPAN-
2-OL
A,B,C,D1PQ90.7
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V970.7
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V980.7
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V960.7
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.71
PNZP-NITRO-BENZYLAMINEA,B2C700.71
BRXBROMAMPHENICOLA,B,C,D,E,F2JKL0.76
SOAISATOIC ANHYDRIDEA1BIO0.72
CLCN-ACETYL-P-NITROPHENYLSERINOLA1GRR0.78
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A,B,C,D1PX00.81
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A,B,C,D2ZHM0.81
RPN(R)-1-PARA-NITRO-PHENYL-2-AZIDO-
ETHANOL
A2ZHN0.81
PRQ(3S)-3-amino-3-(2-nitrophenyl)propanoic acidC,F,I,L2VE60.76