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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01725442

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.75
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.75
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.75
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.75
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.75
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A1T3T0.72
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,B,C,D,E,F,
G,H
1A9X0.72
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,D,E,H,I,L3D540.72
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,B,C,D,E,F,
G,H
1CS00.72
B3D3-AMINOPENTANEDIOIC ACIDA,B,C2OXJ0.79
B3D3-AMINOPENTANEDIOIC ACIDA,B,C,D3C3F0.79
B3D3-AMINOPENTANEDIOIC ACIDA2OXK0.79
B3D3-AMINOPENTANEDIOIC ACIDA3C3G0.79
B3D3-AMINOPENTANEDIOIC ACIDA3C3H0.79
6CL6-CARBOXYLYSINEU2AIZ0.7
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D1J730.75
DAB2,4-DIAMINOBUTYRIC ACIDA1JDK0.75
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D3D3S0.75
DAB2,4-DIAMINOBUTYRIC ACIDA,B3DS90.75
DAB2,4-DIAMINOBUTYRIC ACIDA1J9V0.75
DAB2,4-DIAMINOBUTYRIC ACIDA2PM10.75
DAB2,4-DIAMINOBUTYRIC ACIDA1JAR0.75
DAB2,4-DIAMINOBUTYRIC ACIDA,B1B4H0.75
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.7
API2,6-DIAMINOPIMELIC ACIDA2DAP0.7
API2,6-DIAMINOPIMELIC ACIDE,S148L0.7
ABAALPHA-AMINOBUTYRIC ACIDA1A3P0.7
ABAALPHA-AMINOBUTYRIC ACIDA,S1RBD0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1ZII0.7
ABAALPHA-AMINOBUTYRIC ACIDM,N,O,P2ZSW0.7
ABAALPHA-AMINOBUTYRIC ACIDA1T9E0.7
ABAALPHA-AMINOBUTYRIC ACIDC,D2OJU0.7
ABAALPHA-AMINOBUTYRIC ACIDB,D,F,H,J,L,
N,P,R,T
2RMA0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6M0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1Z1H0.7
ABAALPHA-AMINOBUTYRIC ACIDA1CYA0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,D1MF80.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,D2J9K0.7
ABAALPHA-AMINOBUTYRIC ACIDD,E,F1XQ70.7
ABAALPHA-AMINOBUTYRIC ACIDB,D,F,H,J,L,
N,P
1C5F0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,I8HVP0.7
ABAALPHA-AMINOBUTYRIC ACIDA1W9N0.7
ABAALPHA-AMINOBUTYRIC ACIDC1CWA0.7
ABAALPHA-AMINOBUTYRIC ACIDA1MQX0.7
ABAALPHA-AMINOBUTYRIC ACIDE,S1Z3L0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,C7HVP0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6J0.7
ABAALPHA-AMINOBUTYRIC ACIDC1IKF0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B3BXS0.7
ABAALPHA-AMINOBUTYRIC ACIDA,M,N2Z6W0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1D4K0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,I4HVP0.7
ABAALPHA-AMINOBUTYRIC ACIDA2JUV0.7
ABAALPHA-AMINOBUTYRIC ACIDA1AJ10.7
ABAALPHA-AMINOBUTYRIC ACIDB3CYS0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1YLC0.7
ABAALPHA-AMINOBUTYRIC ACIDA1C2U0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,C2J9J0.7
ABAALPHA-AMINOBUTYRIC ACIDC1CWB0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,C,D,E,F1QOW0.7
ABAALPHA-AMINOBUTYRIC ACIDD1QNG0.7
ABAALPHA-AMINOBUTYRIC ACIDA9JDW0.7
ABAALPHA-AMINOBUTYRIC ACIDA1CYB0.7
ABAALPHA-AMINOBUTYRIC ACIDA1WZ50.7
ABAALPHA-AMINOBUTYRIC ACIDA3HVP0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6P0.7
ABAALPHA-AMINOBUTYRIC ACIDC1CYN0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1MTR0.7
ABAALPHA-AMINOBUTYRIC ACIDB,D,F,H2RMC0.7
ABAALPHA-AMINOBUTYRIC ACIDA1BBO0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,D,E,F,H1M630.7
ABAALPHA-AMINOBUTYRIC ACIDE,F2ZOL0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B3BXR0.7
ABAALPHA-AMINOBUTYRIC ACIDC1CWM0.7
ABAALPHA-AMINOBUTYRIC ACIDA1CSA0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1D4L0.7
ABAALPHA-AMINOBUTYRIC ACIDC1CWL0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1Z1R0.7
ABAALPHA-AMINOBUTYRIC ACIDA,C,F,H2C5V0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,C,D,E,F2ZSV0.7
ABAALPHA-AMINOBUTYRIC ACIDA,C,E,G,I,J,
K,L
2ZOK0.7
ABAALPHA-AMINOBUTYRIC ACIDB,D,F,H,J,L,
N,P,R,T
2RMB0.7
ABAALPHA-AMINOBUTYRIC ACIDA1MQZ0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.7
ABAALPHA-AMINOBUTYRIC ACIDC1CWH0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,C,D,E,F,
G,H
3BO70.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1YLD0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,I3DCR0.7
ABAALPHA-AMINOBUTYRIC ACIDA,I2O400.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1K090.7
ABAALPHA-AMINOBUTYRIC ACIDB1T1Q0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6K0.7
ABAALPHA-AMINOBUTYRIC ACIDA1MQY0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,I3DCK0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B1B6L0.7
ABAALPHA-AMINOBUTYRIC ACIDA2DDE0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,C1CPI0.7
ABAALPHA-AMINOBUTYRIC ACIDA,B,C1ZIJ0.7
ABAALPHA-AMINOBUTYRIC ACIDA1BAH0.7
ABAALPHA-AMINOBUTYRIC ACIDC,D1QNH0.7
ABAALPHA-AMINOBUTYRIC ACIDT,U,V2POY0.7
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.75
CAB4-CARBOXY-4-AMINOBUTANALA,B,M,N1FJM0.8
CAB4-CARBOXY-4-AMINOBUTANALC,I2IE30.8
CAB4-CARBOXY-4-AMINOBUTANALC,F,X,Y2NPP0.8
CAB4-CARBOXY-4-AMINOBUTANALA,B1DJO0.8
DLED-LEUCINEA,B1ALZ0.73
DLED-LEUCINEA,B1BDW0.73
DLED-LEUCINEA,D1CZQ0.73
DLED-LEUCINEA1BFW0.73
DLED-LEUCINEE,F,G,H1XN20.73
DLED-LEUCINEA,B,C,D1GMK0.73
DLED-LEUCINEA,B1TKQ0.73
DLED-LEUCINEA,B,C,H,K,L2R5D0.73
DLED-LEUCINEA2NPV0.73
DLED-LEUCINEA,B,C,D2R3C0.73
DLED-LEUCINEB,D,E1AFQ0.73
DLED-LEUCINEA,B1MIC0.73
DLED-LEUCINEA,B1NRU0.73
DLED-LEUCINEA,B1JNO0.73
DLED-LEUCINEA,B1GRM0.73
DLED-LEUCINEA,B1NRM0.73
DLED-LEUCINEA,D2Q3I0.73
DLED-LEUCINEA,B1NT50.73
DLED-LEUCINEA2JUE0.73
DLED-LEUCINEA,B,C,D1AV20.73
DLED-LEUCINEA1YY20.73
DLED-LEUCINEA,B1AL40.73
DLED-LEUCINEA,B1NG80.73
DLED-LEUCINEA,B1ALX0.73
DLED-LEUCINEA,B1JO40.73
DLED-LEUCINEA,B,C,H,K,L2R5B0.73
DLED-LEUCINEA,B1MAG0.73
DLED-LEUCINEA,B1NT60.73
DLED-LEUCINEA,B2Q330.73
DLED-LEUCINEA,B1JO30.73
DLED-LEUCINEE,I1BLL0.73
DLED-LEUCINEA,B1KQE0.73
DLED-LEUCINEA,B,C,D1W5U0.73
DLED-LEUCINEA,B,C,D2IZQ0.73
DLED-LEUCINEA1C4B0.73
DLED-LEUCINEA,B,C,D1C4D0.73
AA42-AMINO-5-HYDROXYPENTANOIC ACIDB1MIK0.82
AA42-AMINO-5-HYDROXYPENTANOIC ACIDE,I1QR30.82
DGLD-GLUTAMIC ACIDA,B2JFX0.93
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.93
DGLD-GLUTAMIC ACIDA1C4B0.93
DGLD-GLUTAMIC ACIDA1CW80.93
DGLD-GLUTAMIC ACIDA,D1CZQ0.93
DGLD-GLUTAMIC ACIDA,B2JFY0.93
DGLD-GLUTAMIC ACIDI1QUR0.93
DGLD-GLUTAMIC ACIDA,D2Q3I0.93
DGLD-GLUTAMIC ACIDA1CVQ0.93
DGLD-GLUTAMIC ACIDA,B1P4N0.93
DGLD-GLUTAMIC ACIDA,B2VVT0.93
DGLD-GLUTAMIC ACIDE,S148L0.93
DGLD-GLUTAMIC ACIDA1KR60.93
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.93
DGLD-GLUTAMIC ACIDA1AY30.93
DGLD-GLUTAMIC ACIDA2J8F0.93
DGLD-GLUTAMIC ACIDU2AIZ0.93
DGLD-GLUTAMIC ACIDA,B,C2DWU0.93
DGLD-GLUTAMIC ACIDL2EAX0.93
DGLD-GLUTAMIC ACIDA,B2JFZ0.93
DGLD-GLUTAMIC ACIDH,I4THN0.93
DGLD-GLUTAMIC ACIDA1CWZ0.93
DGLD-GLUTAMIC ACIDP1MCK0.93
DGLD-GLUTAMIC ACIDA2JUE0.93
DGLD-GLUTAMIC ACIDA,B2JFO0.93
DGLD-GLUTAMIC ACIDA3H410.93
DGLD-GLUTAMIC ACIDA1D0K0.93
DGLD-GLUTAMIC ACIDL,N1WCO0.93
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.93
DGLD-GLUTAMIC ACIDH,I5GDS0.93
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.93
DGLD-GLUTAMIC ACIDA,B2JFQ0.93
DGLD-GLUTAMIC ACIDA,B2Q330.93
DGLD-GLUTAMIC ACIDA,B2JFP0.93
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.93
DGLD-GLUTAMIC ACIDA2J8G0.93
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.93
DGND-GLUTAMINEA,D2Q3I0.77
DGND-GLUTAMINEA,L1ZEA0.77
DGND-GLUTAMINEA,B2FCM0.77
DGND-GLUTAMINEA1BFW0.77
DGND-GLUTAMINEE1EPR0.77
DGND-GLUTAMINEA2JX40.77
DGND-GLUTAMINEA,B,C,D2R3C0.77
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.77
DGND-GLUTAMINEA,B2Q330.77
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.77
DGND-GLUTAMINEA,B,C1YJ10.77
DGND-GLUTAMINEA1B740.77
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.76
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1Q8H0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WV70.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2EC90.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,H,L,U2C4F0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2DPQ0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDL1PFX0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1Z6J0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AG70.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDC,H,L,T2FIR0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1ONU0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZZU0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1W2K0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WTG0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1TGG0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,I,L,T2B8O0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1NL10.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WQV0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2PF20.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WHE0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WUN0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L,T2AER0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1ONT0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WCT0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,G1IOD0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1W0Y0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AWY0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDC,H,L1DAN0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1VZM0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2AEI0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDG,L1NL00.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AD70.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZP00.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1Q3M0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1J350.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1P0S0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WHF0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZWL0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1CFI0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2O6N0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1MTQ0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L,T2A2Q0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1J340.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WSS0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C,D1LQV0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1MGX0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B2DPR0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2SPT0.8
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1NL20.8
DLYD-LYSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.73
DLYD-LYSINEA1C4B0.73
DLYD-LYSINEA,B,C,D3BOG0.73
DLYD-LYSINEA1KO00.73
DLYD-LYSINEA,B,C,D3C1P0.73
DLYD-LYSINEA,B,C,H,K,L2R5D0.73
DLYD-LYSINEA,B,C,D2R3C0.73
DLYD-LYSINEA,B,C,H,K,L2R5B0.73
DLYD-LYSINEA,B2Q330.73
DLYD-LYSINEA,B2ATS0.73
DLYD-LYSINEA1RCQ0.73
DNED-NORLEUCINEA1R9V0.73
DNED-NORLEUCINEA,B1S4A0.73
DNED-NORLEUCINEA,B1S1O0.73
DBBD-ALPHA-AMINOBUTYRIC ACIDL,N1WCO0.7
DBBD-ALPHA-AMINOBUTYRIC ACIDC1CWC0.7
DBBD-ALPHA-AMINOBUTYRIC ACIDE,I1QR30.7
DBBD-ALPHA-AMINOBUTYRIC ACIDA,F,L,S2D7F0.7
CGACARBOXYMETHYLATED GLUTAMIC ACIDA1DET0.75
DILD-ISOLEUCINEA,B2Q330.73
DILD-ISOLEUCINEA1CWZ0.73
DILD-ISOLEUCINEA1CVQ0.73
DILD-ISOLEUCINEA1C4B0.73
DILD-ISOLEUCINEA1CW80.73
DILD-ISOLEUCINEA2AP80.73