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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01531285

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MAQ2-AMINO-8-METHYLQUINAZOLIN-4(3H)-
ONE
A1S380.77
TPM2-(4-AMINOBENZYLAMINO)-3,4,5,6-
TETRAHYDROPYRIDINIUM
J,K,L1F3D0.75
3AB3-aminobenzamideA,B,C,D3GOY0.72
AQO2-AMINOQUINAZOLIN-4(3H)-ONEA1S390.82
GCA6-(3',5'-DIMETHYLBENZYL)-1-ETHOXYMETHYL-
5-ISOPROPYLURACIL
A1C1B0.71
LGD6-[BIS(2,2,2-TRIFLUOROETHYL)AMINO]-
4-(TRIFLUOROMETHYL)QUINOLIN-2(1H)-
ONE
A2HVC0.7
BHB2,6-DIAMINO-8-(2-DIMETHYLAMINOETHYLSULFANYLMETHYL)-
3H-QUINAZOLIN-4-ONE
A1Q650.74
V152-AMINO-6-(2-PHENYLETHYL)PYRIMIDIN-
4(3H)-ONE
A2V000.83
LFNLUMIFLAVINA2CCC0.73
4PG1-[4-(2-oxo-2-phenylethyl)phenyl]guanidineU2R2W0.72
AZQAZAPROPAZONEA2BXK0.71
AZQAZAPROPAZONEA2BXI0.71
AZQAZAPROPAZONEA,B2BX80.71
MKC6-BENZYL-1-ETHOXYMETHYL-5-ISOPROPYL URACILA1RT10.73
12Q1-METHYLQUINOLIN-2(1H)-ONEA,B2F640.71
OCHQUINOLIN-2(1H)-ONEA,B,C,D,E,F1Z030.74
APQ2,6-DIAMINO-8-PROPYLSULFANYLMETHYL-
3H-QUINAZOLINE-4-ONE
A1K4H0.76