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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03034640

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NEB2-DEOXY-D-STREPTAMINEA1NEM0.71
CGACARBOXYMETHYLATED GLUTAMIC ACIDA1DET0.71
FHL(E)-N~6~-[3-CARBOXY-1-(HYDROXYMETHYL)PROPYLIDENE]-
L-LYSINE
A,B2C130.71
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.71
DGLD-GLUTAMIC ACIDA,B2JFX0.72
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.72
DGLD-GLUTAMIC ACIDA1C4B0.72
DGLD-GLUTAMIC ACIDA1CW80.72
DGLD-GLUTAMIC ACIDA,D1CZQ0.72
DGLD-GLUTAMIC ACIDA,B2JFY0.72
DGLD-GLUTAMIC ACIDI1QUR0.72
DGLD-GLUTAMIC ACIDA,D2Q3I0.72
DGLD-GLUTAMIC ACIDA1CVQ0.72
DGLD-GLUTAMIC ACIDA,B1P4N0.72
DGLD-GLUTAMIC ACIDA,B2VVT0.72
DGLD-GLUTAMIC ACIDE,S148L0.72
DGLD-GLUTAMIC ACIDA1KR60.72
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.72
DGLD-GLUTAMIC ACIDA1AY30.72
DGLD-GLUTAMIC ACIDA2J8F0.72
DGLD-GLUTAMIC ACIDU2AIZ0.72
DGLD-GLUTAMIC ACIDA,B,C2DWU0.72
DGLD-GLUTAMIC ACIDL2EAX0.72
DGLD-GLUTAMIC ACIDA,B2JFZ0.72
DGLD-GLUTAMIC ACIDH,I4THN0.72
DGLD-GLUTAMIC ACIDA1CWZ0.72
DGLD-GLUTAMIC ACIDP1MCK0.72
DGLD-GLUTAMIC ACIDA2JUE0.72
DGLD-GLUTAMIC ACIDA,B2JFO0.72
DGLD-GLUTAMIC ACIDA3H410.72
DGLD-GLUTAMIC ACIDA1D0K0.72
DGLD-GLUTAMIC ACIDL,N1WCO0.72
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.72
DGLD-GLUTAMIC ACIDH,I5GDS0.72
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.72
DGLD-GLUTAMIC ACIDA,B2JFQ0.72
DGLD-GLUTAMIC ACIDA,B2Q330.72
DGLD-GLUTAMIC ACIDA,B2JFP0.72
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.72
DGLD-GLUTAMIC ACIDA2J8G0.72
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.72
DHH(S)-2-AMINO-7,7-DIHYDROXYHEPTANOIC ACIDA,B,C1T5F0.75
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.75
UN12-AMINOHEXANEDIOIC ACIDA,B,C,D1H0G0.77
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.83
CYY2-DEOXYSTREPTAMINEA1QD30.71
AHHAMINO-HYDROXYHEPTANOIC ACIDA,I3MAT0.75
LIS(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACIDA,B1O900.72
LIS(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACIDA,B1O930.72
NPI2-AMINOPIMELIC ACIDA2TDT0.73
NPI2-AMINOPIMELIC ACIDA1KGQ0.73
LYZ5-HYDROXYLYSINEA,B,C,D1QGW0.9
LYZ5-HYDROXYLYSINEA,B,C,D1XG00.9
LYZ5-HYDROXYLYSINEA,B,C,D1XF60.9
LYZ5-HYDROXYLYSINEA,B,C1YGV0.9
LYZ5-HYDROXYLYSINEA,B,C1Y0F0.9
MKE(4S)-4-AMINO-5-OXOHEXANOIC ACIDA,I2HAL0.7
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
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2CV10.75
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2DXI0.75
EKE(4S,5R)-4-AMINO-5-HYDROXYHEXANOIC ACIDA,I2HAL0.85
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
AA42-AMINO-5-HYDROXYPENTANOIC ACIDB1MIK0.78
AA42-AMINO-5-HYDROXYPENTANOIC ACIDE,I1QR30.78
6CL6-CARBOXYLYSINEU2AIZ0.71
NLENORLEUCINEA1MMT0.73
NLENORLEUCINEA,B1JB60.73
NLENORLEUCINEC1K2B0.73
NLENORLEUCINEA,B,C2AVQ0.73
NLENORLEUCINEC,D,I,L1R1L0.73
NLENORLEUCINEE,S2RLN0.73
NLENORLEUCINEE,S1Z3L0.73
NLENORLEUCINEA,B,C2AOD0.73
NLENORLEUCINEA,B,C2J9J0.73
NLENORLEUCINEA,B,I4HVP0.73
NLENORLEUCINEA,B,C2AVM0.73
NLENORLEUCINEB,C1K1T0.73
NLENORLEUCINEA,B,C2AOC0.73
NLENORLEUCINEA,B,C2JE40.73
NLENORLEUCINEA,B,I3DCK0.73
NLENORLEUCINEB1EOL0.73
NLENORLEUCINEA1FF00.73
NLENORLEUCINEA1FG60.73
NLENORLEUCINEA1FGC0.73
NLENORLEUCINEE,S1Z3M0.73
NLENORLEUCINEA2RME0.73
NLENORLEUCINEB1FGL0.73
NLENORLEUCINEC1K1U0.73
NLENORLEUCINEA,B1B7H0.73
NLENORLEUCINEA1HTH0.73
NLENORLEUCINEA,B,D2J9K0.73
NLENORLEUCINEA2RMD0.73
NLENORLEUCINEA,B,C2AOG0.73
NLENORLEUCINEA2RMI0.73
NLENORLEUCINEI1EPO0.73
NLENORLEUCINEA1FFI0.73
NLENORLEUCINEA1HD90.73
NLENORLEUCINEA1FFF0.73
NLENORLEUCINEB2JND0.73
NLENORLEUCINEA1FEJ0.73
NLENORLEUCINEA2K9E0.73
NLENORLEUCINEC1CFN0.73
NLENORLEUCINEC1K2C0.73
NLENORLEUCINEA1WY40.73
NLENORLEUCINEA1FQ80.73
NLENORLEUCINEA,B1S1O0.73
NLENORLEUCINEA2F4K0.73
NLENORLEUCINEA,B1D5E0.73
NLENORLEUCINEA2JX40.73
NLENORLEUCINEA1FG80.73
NLENORLEUCINEA1WY30.73
NLENORLEUCINEI1YTJ0.73
NLENORLEUCINEA,B,I3DCR0.73
NLENORLEUCINEA,I2O400.73
NLENORLEUCINEA,B2GYP0.73
NLENORLEUCINEC,F1A8K0.73
NLENORLEUCINEC1BAI0.73
NLENORLEUCINEA,B2JT90.73
NLENORLEUCINEA2RM90.73
NLENORLEUCINEA,B1DAZ0.73
NLENORLEUCINEA1F3R0.73
NLENORLEUCINEA,I2JXR0.73
NLENORLEUCINEC,F1A940.73
NLENORLEUCINEA,B1S4A0.73
NLENORLEUCINEA1R9V0.73
NLENORLEUCINEA,B,C,D,E,F2Z2T0.73
KAH5-AMINO-4-HYDROXYHEXANOIC ACIDA1H7P0.78
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.71
API2,6-DIAMINOPIMELIC ACIDA2DAP0.71
API2,6-DIAMINOPIMELIC ACIDE,S148L0.71
EXY6-[(2R)-oxiran-2-yl]-L-norleucineA,B3DJ80.72
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
DO22-AMINO-6-OXO-HEXANOIC ACIDA,B1DJP0.73
LDO6-HYDROXY-L-NORLEUCINEA,B,C,D1JSR0.83
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RUA0.7
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RUL0.7
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RU90.7
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M3CQZ0.76
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M1K830.76
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,
M,T
2VUM0.76