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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03007513

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.71
DON6-DIAZENYL-5-OXO-L-NORLEUCINEA,B2OSU0.71
6CL6-CARBOXYLYSINEU2AIZ0.7
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.7
API2,6-DIAMINOPIMELIC ACIDA2DAP0.7
API2,6-DIAMINOPIMELIC ACIDE,S148L0.7
DGLD-GLUTAMIC ACIDA,B2JFX0.77
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.77
DGLD-GLUTAMIC ACIDA1C4B0.77
DGLD-GLUTAMIC ACIDA1CW80.77
DGLD-GLUTAMIC ACIDA,D1CZQ0.77
DGLD-GLUTAMIC ACIDA,B2JFY0.77
DGLD-GLUTAMIC ACIDI1QUR0.77
DGLD-GLUTAMIC ACIDA,D2Q3I0.77
DGLD-GLUTAMIC ACIDA1CVQ0.77
DGLD-GLUTAMIC ACIDA,B1P4N0.77
DGLD-GLUTAMIC ACIDA,B2VVT0.77
DGLD-GLUTAMIC ACIDE,S148L0.77
DGLD-GLUTAMIC ACIDA1KR60.77
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.77
DGLD-GLUTAMIC ACIDA1AY30.77
DGLD-GLUTAMIC ACIDA2J8F0.77
DGLD-GLUTAMIC ACIDU2AIZ0.77
DGLD-GLUTAMIC ACIDA,B,C2DWU0.77
DGLD-GLUTAMIC ACIDL2EAX0.77
DGLD-GLUTAMIC ACIDA,B2JFZ0.77
DGLD-GLUTAMIC ACIDH,I4THN0.77
DGLD-GLUTAMIC ACIDA1CWZ0.77
DGLD-GLUTAMIC ACIDP1MCK0.77
DGLD-GLUTAMIC ACIDA2JUE0.77
DGLD-GLUTAMIC ACIDA,B2JFO0.77
DGLD-GLUTAMIC ACIDA3H410.77
DGLD-GLUTAMIC ACIDA1D0K0.77
DGLD-GLUTAMIC ACIDL,N1WCO0.77
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.77
DGLD-GLUTAMIC ACIDH,I5GDS0.77
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.77
DGLD-GLUTAMIC ACIDA,B2JFQ0.77
DGLD-GLUTAMIC ACIDA,B2Q330.77
DGLD-GLUTAMIC ACIDA,B2JFP0.77
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.77
DGLD-GLUTAMIC ACIDA2J8G0.77
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.77
C5A(1S,3S)-1-aminocyclopentane-1,3-
dicarboxylic acid
A,B2E4W0.75
C5B(1S,3R)-1-AMINOCYCLOPENTANE-1,3-
DICARBOXYLIC ACID
A,B2E4X0.75
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1Q8H0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WV70.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2EC90.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,H,L,U2C4F0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2DPQ0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDL1PFX0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1Z6J0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AG70.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDC,H,L,T2FIR0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1ONU0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZZU0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1W2K0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WTG0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1TGG0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,I,L,T2B8O0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1NL10.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WQV0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2PF20.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WHE0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WUN0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L,T2AER0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1ONT0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WCT0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,G1IOD0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1W0Y0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AWY0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDC,H,L1DAN0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1VZM0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2AEI0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDG,L1NL00.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AD70.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZP00.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1Q3M0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1J350.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1P0S0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WHF0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZWL0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1CFI0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2O6N0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1MTQ0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L,T2A2Q0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1J340.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WSS0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C,D1LQV0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1MGX0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B2DPR0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2SPT0.78
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1NL20.78
DLED-LEUCINEA,B1ALZ0.75
DLED-LEUCINEA,B1BDW0.75
DLED-LEUCINEA,D1CZQ0.75
DLED-LEUCINEA1BFW0.75
DLED-LEUCINEE,F,G,H1XN20.75
DLED-LEUCINEA,B,C,D1GMK0.75
DLED-LEUCINEA,B1TKQ0.75
DLED-LEUCINEA,B,C,H,K,L2R5D0.75
DLED-LEUCINEA2NPV0.75
DLED-LEUCINEA,B,C,D2R3C0.75
DLED-LEUCINEB,D,E1AFQ0.75
DLED-LEUCINEA,B1MIC0.75
DLED-LEUCINEA,B1NRU0.75
DLED-LEUCINEA,B1JNO0.75
DLED-LEUCINEA,B1GRM0.75
DLED-LEUCINEA,B1NRM0.75
DLED-LEUCINEA,D2Q3I0.75
DLED-LEUCINEA,B1NT50.75
DLED-LEUCINEA2JUE0.75
DLED-LEUCINEA,B,C,D1AV20.75
DLED-LEUCINEA1YY20.75
DLED-LEUCINEA,B1AL40.75
DLED-LEUCINEA,B1NG80.75
DLED-LEUCINEA,B1ALX0.75
DLED-LEUCINEA,B1JO40.75
DLED-LEUCINEA,B,C,H,K,L2R5B0.75
DLED-LEUCINEA,B1MAG0.75
DLED-LEUCINEA,B1NT60.75
DLED-LEUCINEA,B2Q330.75
DLED-LEUCINEA,B1JO30.75
DLED-LEUCINEE,I1BLL0.75
DLED-LEUCINEA,B1KQE0.75
DLED-LEUCINEA,B,C,D1W5U0.75
DLED-LEUCINEA,B,C,D2IZQ0.75
DLED-LEUCINEA1C4B0.75
DLED-LEUCINEA,B,C,D1C4D0.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.75
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.75
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.72
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.74
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.73
CHGCYCLOHEXYL-GLYCINEH,I4THN0.73
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.73
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.73
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.76
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.76
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.76
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.76
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.71
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.71
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.71
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.71
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.71
B3L(3S)-3-amino-5-methylhexanoic acidA3C3H0.73
B3L(3S)-3-amino-5-methylhexanoic acidA3C3G0.73
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C,D3C3F0.73
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C3HEZ0.73
B3L(3S)-3-amino-5-methylhexanoic acidA,B,D,E,F3FDM0.73
DLYD-LYSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.72
DLYD-LYSINEA1C4B0.72
DLYD-LYSINEA,B,C,D3BOG0.72
DLYD-LYSINEA1KO00.72
DLYD-LYSINEA,B,C,D3C1P0.72
DLYD-LYSINEA,B,C,H,K,L2R5D0.72
DLYD-LYSINEA,B,C,D2R3C0.72
DLYD-LYSINEA,B,C,H,K,L2R5B0.72
DLYD-LYSINEA,B2Q330.72
DLYD-LYSINEA,B2ATS0.72
DLYD-LYSINEA1RCQ0.72
DNED-NORLEUCINEA1R9V0.75
DNED-NORLEUCINEA,B1S4A0.75
DNED-NORLEUCINEA,B1S1O0.75
2CG(1R,2R)-3-[(S)-amino(carboxy)methyl]cyclopropane-
1,2-dicarboxylic acid
A,B2E4V0.8
DILD-ISOLEUCINEA,B2Q330.75
DILD-ISOLEUCINEA1CWZ0.75
DILD-ISOLEUCINEA1CVQ0.75
DILD-ISOLEUCINEA1C4B0.75
DILD-ISOLEUCINEA1CW80.75
DILD-ISOLEUCINEA2AP80.75