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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01234007

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
A185-(2-CHLOROBENZYL)-2-FUROIC ACIDA2Q960.88
C177-[(3-CHLOROBENZYL)OXY]-2-OXO-2H-
CHROMENE-4-CARBALDEHYDE
A,B2V600.73
FOA2-FUROIC ACIDA,B2GF30.73
FOA2-FUROIC ACIDA,B,D2GAG0.73
FOA2-FUROIC ACIDA,B,C,D2GAH0.73
FU2FURFURALA,B,C,D1QXD0.71
ANN4-METHOXYBENZOIC ACIDA2B960.72
ANN4-METHOXYBENZOIC ACIDA2QUE0.72
ANN4-METHOXYBENZOIC ACIDA1SV30.72
ANN4-METHOXYBENZOIC ACIDA1O2E0.72
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.72
FCD5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACIDA1XNZ0.86
AI73-(heptyloxy)benzoic acidA,B2O3Z0.71
FC25-(2,5-DICHLOROPHENYL)-2-FUROIC ACIDA2EVM0.84
FC35-[2-(TRIFLUOROMETHYL)PHENYL]-2-
FUROIC ACID
A2EVC0.78
8MOMETHOXSALENA,B,C,D1Z110.7
A045-[2-(TRIFLUOROMETHOXY)PHENYL]-
2-FUROIC ACID
A2Q940.75
YE65-(2-chlorophenyl)furan-2-carbohydrazideA2P9A0.72
YE65-(2-chlorophenyl)furan-2-carbohydrazideA2P990.72
BZFBENZOFURANA182L0.72
DBA(2,6-DIMETHYL-PHENOXY)-ACETIC ACIDA,B1IDB0.7
34C(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACIDA,B1HT80.74
L1O4-(2-aminoethoxy)-3,5-dichlorobenzoic acidA2VIO0.71
MOFMOMETASONE FUROATEA,B1SR70.7
GRR(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acidA3CDS0.7
YRG(2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acidA3CDP0.78
B215-(2-METHOXYPHENYL)-2-FUROIC ACIDA2Q930.76
EAAETHACRYNIC ACIDA,B3DGQ0.77
EAAETHACRYNIC ACIDA,B11GS0.77
EAAETHACRYNIC ACIDA,B,C,D1GSF0.77
EAAETHACRYNIC ACIDA,B2GSS0.77
EAAETHACRYNIC ACIDA,B3GSS0.77
EAAETHACRYNIC ACIDA,B1GSE0.77