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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206579

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ILGGLUTAMYL GROUPA1EVC0.74
ILGGLUTAMYL GROUPA1XY50.74
ILGGLUTAMYL GROUPA1EVA0.74
ILGGLUTAMYL GROUPA1LCM0.74
ILGGLUTAMYL GROUPC,D2GSR0.74
ILGGLUTAMYL GROUPA1XY40.74
ILGGLUTAMYL GROUPA,B,C,D,E,F,
G,H
1AQX0.74
ILGGLUTAMYL GROUPA,B,C,D,E,F,
G,H
1AQW0.74
ILGGLUTAMYL GROUPA1EVB0.74
ILGGLUTAMYL GROUPA,B,C,D1I7Q0.74
ILGGLUTAMYL GROUPA,B1GAC0.74
ILGGLUTAMYL GROUPA1EVD0.74
ILGGLUTAMYL GROUPA,B,C,D1AQV0.74
SYM2S,4R-4-METHYLGLUTAMATEA,B1SD30.72
CGACARBOXYMETHYLATED GLUTAMIC ACIDA1DET0.76
RGPGAMMA-GLUTAMYL PHOSPHATEA,B2J5V0.71
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2CV10.82
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2DXI0.82
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J320.77
ASKDEHYDROXYMETHYLASPARTIC ACIDE,F1JXQ0.77
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I2F4O0.77
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I1X3Z0.77
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJX0.77
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J330.77
ASKDEHYDROXYMETHYLASPARTIC ACIDT,U,V,W,X,Y1QDU0.77
ASKDEHYDROXYMETHYLASPARTIC ACIDC,D1CP30.77
ASKDEHYDROXYMETHYLASPARTIC ACIDA,B,C,D,E,F1M720.77
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J300.77
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J310.77
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJY0.77
FKI5,5-DI-FLUORO-2-KETO-3-AMINOPENTANOIC ACIDB,E,F1DY90.71
FKI5,5-DI-FLUORO-2-KETO-3-AMINOPENTANOIC ACIDA,B1DXW0.71
FKI5,5-DI-FLUORO-2-KETO-3-AMINOPENTANOIC ACIDE,F1DY80.71
LAA(3R)-3-hydroxy-L-alpha-asparagineA1CCF0.74
LDO6-HYDROXY-L-NORLEUCINEA,B,C,D1JSR0.72
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M3CQZ0.77
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M1K830.77
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,
M,T
2VUM0.77
LIS(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACIDA,B1O900.78
LIS(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACIDA,B1O930.78
BHDBETA-HYDROXYASPARTIC ACIDA1WHE0.73
BHDBETA-HYDROXYASPARTIC ACIDA2DDE0.73
BHDBETA-HYDROXYASPARTIC ACIDC,L1XKA0.73
BHDBETA-HYDROXYASPARTIC ACIDA1ERM0.73
BHDBETA-HYDROXYASPARTIC ACIDL,P1AUT0.73
BHDBETA-HYDROXYASPARTIC ACIDA1WHF0.73
BHDBETA-HYDROXYASPARTIC ACIDL1PFX0.73
BHDBETA-HYDROXYASPARTIC ACIDA,B,C,D1XKB0.73
AHBBETA-HYDROXYASPARAGINEA1DSR0.76
AHBBETA-HYDROXYASPARAGINEA,G1NT00.76
AHBBETA-HYDROXYASPARAGINEA2ZGD0.76
AHBBETA-HYDROXYASPARAGINEA,B2QC90.76
AHBBETA-HYDROXYASPARAGINEA2OG70.76
FGA5-oxo-D-norvalineC,F,G,H3DW80.74
FGA5-oxo-D-norvalineA,B,C,D,E,F,
G,H
2NYL0.74
FGA5-oxo-D-norvalineC,F,M,N2IAE0.74
FGA5-oxo-D-norvalineA,B,C,D,E,F,
G,H
2NYM0.74
ASBASPARTIC ACID-4-CARBOXYMETHYL ESTERA,B1QQ60.71
ASBASPARTIC ACID-4-CARBOXYMETHYL ESTERA,B1QQ70.71
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA2OXK0.71
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA,B,C2OXJ0.71
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA1J8N0.71
LME(3R)-3-METHYL-L-GLUTAMIC ACIDA1XT70.72
MKE(4S)-4-AMINO-5-OXOHEXANOIC ACIDA,I2HAL0.7
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.72
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.71
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.71
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.71
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.71
NVANORVALINEB,C1CA80.73
NVANORVALINEB,C,D1BA80.73
NVANORVALINEA1C9Y0.73
NVANORVALINEA,D2BTE0.73
NVANORVALINEA1OBH0.73
NVANORVALINEE,S1Z3P0.73
NVANORVALINEA1ZNM0.73
NVANORVALINEA1JDX0.73
NVANORVALINEA1FB50.73
NVANORVALINEA1OBC0.73
NVANORVALINE11YYY0.73
NVANORVALINEA,B1B6H0.73
NVANORVALINEA,B1ZZZ0.73
NVANORVALINEA,B,C2I6U0.73
NVANORVALINEB,C1BB00.73
NVANORVALINEE,S1Z3M0.73
AS2(2R)-2-AMINO-4-OXOBUTANOIC ACIDA,B,C,D2GZ30.71
DGLD-GLUTAMIC ACIDA,B2JFX0.79
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.79
DGLD-GLUTAMIC ACIDA1C4B0.79
DGLD-GLUTAMIC ACIDA1CW80.79
DGLD-GLUTAMIC ACIDA,D1CZQ0.79
DGLD-GLUTAMIC ACIDA,B2JFY0.79
DGLD-GLUTAMIC ACIDI1QUR0.79
DGLD-GLUTAMIC ACIDA,D2Q3I0.79
DGLD-GLUTAMIC ACIDA1CVQ0.79
DGLD-GLUTAMIC ACIDA,B1P4N0.79
DGLD-GLUTAMIC ACIDA,B2VVT0.79
DGLD-GLUTAMIC ACIDE,S148L0.79
DGLD-GLUTAMIC ACIDA1KR60.79
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.79
DGLD-GLUTAMIC ACIDA1AY30.79
DGLD-GLUTAMIC ACIDA2J8F0.79
DGLD-GLUTAMIC ACIDU2AIZ0.79
DGLD-GLUTAMIC ACIDA,B,C2DWU0.79
DGLD-GLUTAMIC ACIDL2EAX0.79
DGLD-GLUTAMIC ACIDA,B2JFZ0.79
DGLD-GLUTAMIC ACIDH,I4THN0.79
DGLD-GLUTAMIC ACIDA1CWZ0.79
DGLD-GLUTAMIC ACIDP1MCK0.79
DGLD-GLUTAMIC ACIDA2JUE0.79
DGLD-GLUTAMIC ACIDA,B2JFO0.79
DGLD-GLUTAMIC ACIDA3H410.79
DGLD-GLUTAMIC ACIDA1D0K0.79
DGLD-GLUTAMIC ACIDL,N1WCO0.79
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.79
DGLD-GLUTAMIC ACIDH,I5GDS0.79
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.79
DGLD-GLUTAMIC ACIDA,B2JFQ0.79
DGLD-GLUTAMIC ACIDA,B2Q330.79
DGLD-GLUTAMIC ACIDA,B2JFP0.79
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.79
DGLD-GLUTAMIC ACIDA2J8G0.79
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.79
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RUA0.75
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RUL0.75
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RU90.75
EKE(4S,5R)-4-AMINO-5-HYDROXYHEXANOIC ACIDA,I2HAL0.74
UN22-AMINO-4,4-DIHYDROXYBUTANOIC ACIDA,B,C,D1H0G0.71
AA42-AMINO-5-HYDROXYPENTANOIC ACIDB1MIK0.85
AA42-AMINO-5-HYDROXYPENTANOIC ACIDE,I1QR30.85
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5N0.72
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5M0.72
LYZ5-HYDROXYLYSINEA,B,C,D1QGW0.76
LYZ5-HYDROXYLYSINEA,B,C,D1XG00.76
LYZ5-HYDROXYLYSINEA,B,C,D1XF60.76
LYZ5-HYDROXYLYSINEA,B,C1YGV0.76
LYZ5-HYDROXYLYSINEA,B,C1Y0F0.76
HSEL-HOMOSERINEA2VDJ0.71
HSEL-HOMOSERINEA,B,C,D1EBU0.71
HSEL-HOMOSERINEA,C1J9N0.71
HSEL-HOMOSERINEA1PQP0.71
HSEL-HOMOSERINEC1H720.71
HSEL-HOMOSERINEE,F3DKS0.71
ASLASPARTIC ACID-4-CARBOXYETHYL ESTERA,B2NO50.7
B3D3-AMINOPENTANEDIOIC ACIDA,B,C2OXJ0.73
B3D3-AMINOPENTANEDIOIC ACIDA,B,C,D3C3F0.73
B3D3-AMINOPENTANEDIOIC ACIDA2OXK0.73
B3D3-AMINOPENTANEDIOIC ACIDA3C3G0.73
B3D3-AMINOPENTANEDIOIC ACIDA3C3H0.73
CAB4-CARBOXY-4-AMINOBUTANALA,B,M,N1FJM0.74
CAB4-CARBOXY-4-AMINOBUTANALC,I2IE30.74
CAB4-CARBOXY-4-AMINOBUTANALC,F,X,Y2NPP0.74
CAB4-CARBOXY-4-AMINOBUTANALA,B1DJO0.74
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.71