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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02627019

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LGD6-[BIS(2,2,2-TRIFLUOROETHYL)AMINO]-
4-(TRIFLUOROMETHYL)QUINOLIN-2(1H)-
ONE
A2HVC0.7
TYZPARA ACETAMIDO BENZOIC ACIDB,C2BNI0.7
TYZPARA ACETAMIDO BENZOIC ACIDA1W5K0.7
TYZPARA ACETAMIDO BENZOIC ACIDA1W5J0.7
ILHA2FQI0.71
SH4(1R)-1-PHENYLETHYL 4-(ACETYLAMINO)BENZYLPHOSPHONATEH1UM40.71
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.72
3FTA2BXV0.71
LI63,4-DIHYDROXY-1-METHYLQUINOLIN-
2(1H)-ONE
A1YXV0.77
OCHQUINOLIN-2(1H)-ONEA,B,C,D,E,F1Z030.73
H126-CHLORO-4-(CYCLOHEXYLOXY)-3-PROPYLQUINOLIN-
2(1H)-ONE
A1TKT0.81
GWB4-[(CYCLOPROPYLETHYNYL)OXY]-6-FLUORO-
3-ISOPROPYLQUINOLIN-2(1H)-ONE
A1TKX0.99
H206-CHLORO-4-(CYCLOHEXYLOXY)-3-ISOPROPYLQUINOLIN-
2(1H)-ONE
A1TL30.83
G3E3-hydroxyquinolin-2(1H)-oneA,B,C,D3G3E0.73
MXX5,8-dimethoxy-1,4-dimethylquinolin-
2(1H)-one
A,B3GAM0.7
EFZ(-)-6-CHLORO-4-CYCLOPROPYLETHYNYL-
4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-
3,1-BENZOXAZIN-2-ONE
A1FKO0.74
EFZ(-)-6-CHLORO-4-CYCLOPROPYLETHYNYL-
4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-
3,1-BENZOXAZIN-2-ONE
A1IKW0.74
EFZ(-)-6-CHLORO-4-CYCLOPROPYLETHYNYL-
4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-
3,1-BENZOXAZIN-2-ONE
A1JKH0.74
EFZ(-)-6-CHLORO-4-CYCLOPROPYLETHYNYL-
4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-
3,1-BENZOXAZIN-2-ONE
A1FK90.74
EFZ(-)-6-CHLORO-4-CYCLOPROPYLETHYNYL-
4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-
3,1-BENZOXAZIN-2-ONE
A1IKV0.74
FENN-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDEA1FEL0.7