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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00303842

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
8FGN-(5'-PHOSPHO-2'-DEOXYGUANOSIN-
8-YL)-2-ACETYLAMINOFLUORENE
A,C,D1X9M0.79
4CO4-HYDROXYPHENACYL COENZYME AA,B1Q4T0.7
4CO4-HYDROXYPHENACYL COENZYME AA1LO70.7
CF22'-deoxy-5'-O-{[2-(7,8-dimethyl-
2,4-dioxo-3,4-dihydrobenzo[g]pteridin-
10(2H)-yl)ethyl]carbamoyl}guanosine
A2VKF0.78
3BK(2R,3R,4S,5R)-2-[6-amino-8-[(3,4-
dichlorophenyl)methylamino]purin-
9-yl]-5-(hydroxymethyl)oxolane-
3,4-diol
A3FZK0.73
ABR(R)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5E0.72
BPG9-(4-HYDROXYBUTYL)-N2-PHENYLGUANINEA,B1QHI0.74
4CA4-HYDROXYBENZYL COENZYME AA1LO80.73
4CA4-HYDROXYBENZYL COENZYME AA1Q4U0.73
AGNA1GNP0.73
2ND2'-DEOXYINOSINEA1Z390.7
5HI(3R,5R)-7-[2-(4-fluorophenyl)-4-
{[(1S)-2-hydroxy-1-phenylethyl]carbamoyl}-
5-(1-methylethyl)-1H-imidazol-1-
yl]-3,5-dihydroxyheptanoic acid
A,B,C,D3CCZ0.7
DBG3-AMINOBENZOPHENONE-4-YL-AMINOHYDROXYPHOSPHINYLAMINOPHOSPHONIC ACID-
GUANYLATE ESTER
A1RVD0.76
DBG3-AMINOBENZOPHENONE-4-YL-AMINOHYDROXYPHOSPHINYLAMINOPHOSPHONIC ACID-
GUANYLATE ESTER
A1CLU0.76
CAGA1GNQ0.77
CAGA1PLJ0.77
CAGX2EVW0.77
CAGA1GNR0.77
CAGX2CL60.77
01A4-Chlorophenacyl-coenzyme AA,B3CW90.73
DZD5'-O-[(R)-{[(R)-{[(3R,4R)-1-(3-
carbamoylbenzyl)-4-hydroxypyrrolidin-
3-yl]methoxy}(hydroxy)phosphoryl]methyl}(hydroxy)phosphoryl]adenosine
A,D3D4B0.72
ABS(S)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5F0.72
DAK4-(N,N-DIMETHYLAMINO)CINNAMOYL-
COA
A,B,C,D,E,F1EY30.75
FA5ADENOSINE-5'-[PHENYLALANINYL-PHOSPHATE]A3CMQ0.73
FA5ADENOSINE-5'-[PHENYLALANINYL-PHOSPHATE]A,B1JJC0.73
4HI(3R,5R)-7-[4-(benzylcarbamoyl)-
2-(4-fluorophenyl)-5-(1-methylethyl)-
1H-imidazol-1-yl]-3,5-dihydroxyheptanoic acid
B,C,D3CCW0.71
BCA4-HYDROXYBENZOYL COENZYME AA,B,C1NZY0.71
BCA4-HYDROXYBENZOYL COENZYME AA,B,C1JXZ0.71
BCA4-HYDROXYBENZOYL COENZYME AA1LO90.71