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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01750114

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
L1O4-(2-aminoethoxy)-3,5-dichlorobenzoic acidA2VIO0.73
YE65-(2-chlorophenyl)furan-2-carbohydrazideA2P9A0.76
YE65-(2-chlorophenyl)furan-2-carbohydrazideA2P990.76
C177-[(3-CHLOROBENZYL)OXY]-2-OXO-2H-
CHROMENE-4-CARBALDEHYDE
A,B2V600.74
BZFBENZOFURANA182L0.71
ANN4-METHOXYBENZOIC ACIDA2B960.74
ANN4-METHOXYBENZOIC ACIDA2QUE0.74
ANN4-METHOXYBENZOIC ACIDA1SV30.74
ANN4-METHOXYBENZOIC ACIDA1O2E0.74
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.74
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERB,C,D2VK00.7
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERA,B,D3MTH0.7
EAAETHACRYNIC ACIDA,B3DGQ0.81
EAAETHACRYNIC ACIDA,B11GS0.81
EAAETHACRYNIC ACIDA,B,C,D1GSF0.81
EAAETHACRYNIC ACIDA,B2GSS0.81
EAAETHACRYNIC ACIDA,B3GSS0.81
EAAETHACRYNIC ACIDA,B1GSE0.81
AI73-(heptyloxy)benzoic acidA,B2O3Z0.71
NRO3-[5-(2-nitropent-1-en-1-yl)furan-
2-yl]benzoic acid
A,B2ZK50.73
FCD5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACIDA1XNZ0.91
FC25-(2,5-DICHLOROPHENYL)-2-FUROIC ACIDA2EVM0.94
FC35-[2-(TRIFLUOROMETHYL)PHENYL]-2-
FUROIC ACID
A2EVC0.8
A055-(2-CHLORO-4-NITROPHENYL)-2-FUROIC ACIDA2Q950.74
VXXVANILLATEA,B1WB60.71
A185-(2-CHLOROBENZYL)-2-FUROIC ACIDA2Q960.91
MOFMOMETASONE FUROATEA,B1SR70.74
34C(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACIDA,B1HT80.74
3972-(4-HYDROXY-PHENYL)BENZOFURAN-
5-OL
A,B1U9E0.7
L41{4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acidA,B3D5F0.71
GRR(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acidA3CDS0.7
A045-[2-(TRIFLUOROMETHOXY)PHENYL]-
2-FUROIC ACID
A2Q940.77
YRG(2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acidA3CDP0.77
8MOMETHOXSALENA,B,C,D1Z110.74
IH5[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-
3,5-DIMETHYLPHENYL]ACETIC ACID
A1NAV0.7
IH5[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-
3,5-DIMETHYLPHENYL]ACETIC ACID
A1NAX0.7
B215-(2-METHOXYPHENYL)-2-FUROIC ACIDA2Q930.81