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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02865197

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M3CQZ0.74
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M1K830.74
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,
M,T
2VUM0.74
CAB4-CARBOXY-4-AMINOBUTANALA,B,M,N1FJM0.87
CAB4-CARBOXY-4-AMINOBUTANALC,I2IE30.87
CAB4-CARBOXY-4-AMINOBUTANALC,F,X,Y2NPP0.87
CAB4-CARBOXY-4-AMINOBUTANALA,B1DJO0.87
SYM2S,4R-4-METHYLGLUTAMATEA,B1SD30.72
CGACARBOXYMETHYLATED GLUTAMIC ACIDA1DET0.76
HSEL-HOMOSERINEA2VDJ0.75
HSEL-HOMOSERINEA,B,C,D1EBU0.75
HSEL-HOMOSERINEA,C1J9N0.75
HSEL-HOMOSERINEA1PQP0.75
HSEL-HOMOSERINEC1H720.75
HSEL-HOMOSERINEE,F3DKS0.75
AVG2-AMINO-4-(2-AMINO-ETHOXY)-BUTYRIC ACIDA1IAY0.71
RGPGAMMA-GLUTAMYL PHOSPHATEA,B2J5V0.71
UN22-AMINO-4,4-DIHYDROXYBUTANOIC ACIDA,B,C,D1H0G0.74
A0A(2S)-2-AMINO-4-(FORMYLOXY)-4-OXOBUTANOIC ACIDA,B2VJM0.71
LIS(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACIDA,B1O900.78
LIS(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACIDA,B1O930.78
CANCANALINEA,B,C2CAN0.73
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
DGND-GLUTAMINEA,D2Q3I0.72
DGND-GLUTAMINEA,L1ZEA0.72
DGND-GLUTAMINEA,B2FCM0.72
DGND-GLUTAMINEA1BFW0.72
DGND-GLUTAMINEE1EPR0.72
DGND-GLUTAMINEA2JX40.72
DGND-GLUTAMINEA,B,C,D2R3C0.72
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.72
DGND-GLUTAMINEA,B2Q330.72
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.72
DGND-GLUTAMINEA,B,C1YJ10.72
DGND-GLUTAMINEA1B740.72
LME(3R)-3-METHYL-L-GLUTAMIC ACIDA1XT70.72
MKE(4S)-4-AMINO-5-OXOHEXANOIC ACIDA,I2HAL0.7
FGA5-oxo-D-norvalineC,F,G,H3DW80.87
FGA5-oxo-D-norvalineA,B,C,D,E,F,
G,H
2NYL0.87
FGA5-oxo-D-norvalineC,F,M,N2IAE0.87
FGA5-oxo-D-norvalineA,B,C,D,E,F,
G,H
2NYM0.87
ONL5-OXO-L-NORLEUCINEA,B1ECG0.72
ONL5-OXO-L-NORLEUCINEA,B,C,D3DLA0.72
ONL5-OXO-L-NORLEUCINEA,X2Q3Z0.72
ONL5-OXO-L-NORLEUCINEA,B1ECC0.72
ONL5-OXO-L-NORLEUCINEA,B3BRM0.72
ONL5-OXO-L-NORLEUCINEA,B1OFE0.72
ONL5-OXO-L-NORLEUCINEA,B2J6H0.72
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RUA0.84
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RUL0.84
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RU90.84
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2CV10.75
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2DXI0.75
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J320.71
ASKDEHYDROXYMETHYLASPARTIC ACIDE,F1JXQ0.71
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I2F4O0.71
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I1X3Z0.71
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJX0.71
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J330.71
ASKDEHYDROXYMETHYLASPARTIC ACIDT,U,V,W,X,Y1QDU0.71
ASKDEHYDROXYMETHYLASPARTIC ACIDC,D1CP30.71
ASKDEHYDROXYMETHYLASPARTIC ACIDA,B,C,D,E,F1M720.71
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J300.71
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J310.71
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJY0.71
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
ASAASPARTIC ALDEHYDEE,F2QLF0.71
ASAASPARTIC ALDEHYDEC3H110.71
ASAASPARTIC ALDEHYDED,E,F2QL90.71
ASAASPARTIC ALDEHYDEC2H5I0.71
ASAASPARTIC ALDEHYDEE,F2H650.71
ASAASPARTIC ALDEHYDEA,B1IAU0.71
ASAASPARTIC ALDEHYDEA,E,F2QLJ0.71
ASAASPARTIC ALDEHYDEE,F2H5J0.71
ASAASPARTIC ALDEHYDED,E,F2QL50.71
ASAASPARTIC ALDEHYDED,E,F2QL70.71
ASAASPARTIC ALDEHYDEE,F3EDR0.71
ASAASPARTIC ALDEHYDEA,B,C1QTN0.71
ASAASPARTIC ALDEHYDED,E,F2QLB0.71
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5N0.72
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5M0.72
AA42-AMINO-5-HYDROXYPENTANOIC ACIDB1MIK0.75
AA42-AMINO-5-HYDROXYPENTANOIC ACIDE,I1QR30.75
DO22-AMINO-6-OXO-HEXANOIC ACIDA,B1DJP0.73
LED(4R)-5-OXO-L-LEUCINEA2IUW0.8
ILGGLUTAMYL GROUPA1EVC0.87
ILGGLUTAMYL GROUPA1XY50.87
ILGGLUTAMYL GROUPA1EVA0.87
ILGGLUTAMYL GROUPA1LCM0.87
ILGGLUTAMYL GROUPC,D2GSR0.87
ILGGLUTAMYL GROUPA1XY40.87
ILGGLUTAMYL GROUPA,B,C,D,E,F,
G,H
1AQX0.87
ILGGLUTAMYL GROUPA,B,C,D,E,F,
G,H
1AQW0.87
ILGGLUTAMYL GROUPA1EVB0.87
ILGGLUTAMYL GROUPA,B,C,D1I7Q0.87
ILGGLUTAMYL GROUPA,B1GAC0.87
ILGGLUTAMYL GROUPA1EVD0.87
ILGGLUTAMYL GROUPA,B,C,D1AQV0.87
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