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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00835008

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FC35-[2-(TRIFLUOROMETHYL)PHENYL]-2-
FUROIC ACID
A2EVC0.84
BZFBENZOFURANA182L0.71
A153'-3"-DICHLOROPHENOL-1,8-3H-BENZO[DE]ISOCHROMEN-
1-ONE
A1TSL0.7
C177-[(3-CHLOROBENZYL)OXY]-2-OXO-2H-
CHROMENE-4-CARBALDEHYDE
A,B2V600.73
CHB3-CHLORO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCH0.71
FC25-(2,5-DICHLOROPHENYL)-2-FUROIC ACIDA2EVM0.91
ANN4-METHOXYBENZOIC ACIDA2B960.73
ANN4-METHOXYBENZOIC ACIDA2QUE0.73
ANN4-METHOXYBENZOIC ACIDA1SV30.73
ANN4-METHOXYBENZOIC ACIDA1O2E0.73
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.73
FCD5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACIDA1XNZ0.92
3972-(4-HYDROXY-PHENYL)BENZOFURAN-
5-OL
A,B1U9E0.71
A045-[2-(TRIFLUOROMETHOXY)PHENYL]-
2-FUROIC ACID
A2Q940.79
AI73-(heptyloxy)benzoic acidA,B2O3Z0.71
EAAETHACRYNIC ACIDA,B3DGQ0.79
EAAETHACRYNIC ACIDA,B11GS0.79
EAAETHACRYNIC ACIDA,B,C,D1GSF0.79
EAAETHACRYNIC ACIDA,B2GSS0.79
EAAETHACRYNIC ACIDA,B3GSS0.79
EAAETHACRYNIC ACIDA,B1GSE0.79
34C(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACIDA,B1HT80.75
B215-(2-METHOXYPHENYL)-2-FUROIC ACIDA2Q930.82
A055-(2-CHLORO-4-NITROPHENYL)-2-FUROIC ACIDA2Q950.74
8MOMETHOXSALENA,B,C,D1Z110.73
L1O4-(2-aminoethoxy)-3,5-dichlorobenzoic acidA2VIO0.71
GRR(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acidA3CDS0.7
IH5[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-
3,5-DIMETHYLPHENYL]ACETIC ACID
A1NAV0.72
IH5[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-
3,5-DIMETHYLPHENYL]ACETIC ACID
A1NAX0.72
A185-(2-CHLOROBENZYL)-2-FUROIC ACIDA2Q960.93