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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00619594

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
C177-[(3-CHLOROBENZYL)OXY]-2-OXO-2H-
CHROMENE-4-CARBALDEHYDE
A,B2V600.74
34C(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACIDA,B1HT80.8
FCD5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACIDA1XNZ0.75
VNL4-HYDROXY-3-METHOXYBENZOATEA,B,C,D2AHC0.75
VNL4-HYDROXY-3-METHOXYBENZOATEA1XLR0.75
L1O4-(2-aminoethoxy)-3,5-dichlorobenzoic acidA2VIO0.75
D1L2-[4-(2,4-DICHLOROPHENOXY)PHENOXY]PROPANOIC ACIDA,B1UYR0.7
CHB3-CHLORO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCH0.71
MPP3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACIDA,B2AY30.72
B215-(2-METHOXYPHENYL)-2-FUROIC ACIDA2Q930.7
VXXVANILLATEA,B1WB60.75
FC25-(2,5-DICHLOROPHENYL)-2-FUROIC ACIDA2EVM0.74
EAAETHACRYNIC ACIDA,B3DGQ0.85
EAAETHACRYNIC ACIDA,B11GS0.85
EAAETHACRYNIC ACIDA,B,C,D1GSF0.85
EAAETHACRYNIC ACIDA,B2GSS0.85
EAAETHACRYNIC ACIDA,B3GSS0.85
EAAETHACRYNIC ACIDA,B1GSE0.85
CFA(2,4-DICHLOROPHENOXY)ACETIC ACIDB,E2P1N0.71
YRG(2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acidA3CDP0.75
AI73-(heptyloxy)benzoic acidA,B2O3Z0.74
8MOMETHOXSALENA,B,C,D1Z110.7
V554-hydroxy-3-methoxybenzaldehydeB,D,E,F2VSS0.77
V554-hydroxy-3-methoxybenzaldehydeA,B,D,E,F2VSU0.77
3002-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATEA1O410.73
IH5[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-
3,5-DIMETHYLPHENYL]ACETIC ACID
A1NAV0.73
IH5[4-(4-HYDROXY-3-ISOPROPYLPHENOXY)-
3,5-DIMETHYLPHENYL]ACETIC ACID
A1NAX0.73
A185-(2-CHLOROBENZYL)-2-FUROIC ACIDA2Q960.75
TN33-CHLORO-4-(4-CHLORO-2-HYDROXYPHENOXY)-
N-METHYLBENZAMIDE
A,B1ZXB0.71
ANN4-METHOXYBENZOIC ACIDA2B960.71
ANN4-METHOXYBENZOIC ACIDA2QUE0.71
ANN4-METHOXYBENZOIC ACIDA1SV30.71
ANN4-METHOXYBENZOIC ACIDA1O2E0.71
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.71
SYRSYRINGATEA,B1WB50.73