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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02359699

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ZAL3-cyclohexyl-D-alanineI1HBT0.72
EXY6-[(2R)-oxiran-2-yl]-L-norleucineA,B3DJ80.76
DON6-DIAZENYL-5-OXO-L-NORLEUCINEA,B2OSU0.71
NPI2-AMINOPIMELIC ACIDA2TDT0.77
NPI2-AMINOPIMELIC ACIDA1KGQ0.77
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.72
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.72
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.72
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.72
ONL5-OXO-L-NORLEUCINEA,B1ECG0.71
ONL5-OXO-L-NORLEUCINEA,B,C,D3DLA0.71
ONL5-OXO-L-NORLEUCINEA,X2Q3Z0.71
ONL5-OXO-L-NORLEUCINEA,B1ECC0.71
ONL5-OXO-L-NORLEUCINEA,B3BRM0.71
ONL5-OXO-L-NORLEUCINEA,B1OFE0.71
ONL5-OXO-L-NORLEUCINEA,B2J6H0.71
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.74
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.74
DOA12-AMINO-DODECANOIC ACIDA2DCX0.74
DOA12-AMINO-DODECANOIC ACIDB1EOL0.74
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EJX0.72
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKE0.72
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.75
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
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.82
AKL3-AMINO-5-CHLORO-4-OXOPENTANOIC ACIDI2DKO0.75
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B1QJ30.81
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B,C,D3FMI0.81
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B3DU40.81
6CL6-CARBOXYLYSINEU2AIZ0.79
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.73
CHGCYCLOHEXYL-GLYCINEH,I4THN0.73
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.73
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.73
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.71
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.79
API2,6-DIAMINOPIMELIC ACIDA2DAP0.79
API2,6-DIAMINOPIMELIC ACIDE,S148L0.79
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.76
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.76
DLYD-LYSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		1YWH0.75
DLYD-LYSINEA1C4B0.75
DLYD-LYSINEA,B,C,D3BOG0.75
DLYD-LYSINEA1KO00.75
DLYD-LYSINEA,B,C,D3C1P0.75
DLYD-LYSINEA,B,C,H,K,L2R5D0.75
DLYD-LYSINEA,B,C,D2R3C0.75
DLYD-LYSINEA,B,C,H,K,L2R5B0.75
DLYD-LYSINEA,B2Q330.75
DLYD-LYSINEA,B2ATS0.75
DLYD-LYSINEA1RCQ0.75
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.77
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.73
DNED-NORLEUCINEA1R9V0.72
DNED-NORLEUCINEA,B1S4A0.72
DNED-NORLEUCINEA,B1S1O0.72
NLENORLEUCINEA1MMT0.72
NLENORLEUCINEA,B1JB60.72
NLENORLEUCINEC1K2B0.72
NLENORLEUCINEA,B,C2AVQ0.72
NLENORLEUCINEC,D,I,L1R1L0.72
NLENORLEUCINEE,S2RLN0.72
NLENORLEUCINEE,S1Z3L0.72
NLENORLEUCINEA,B,C2AOD0.72
NLENORLEUCINEA,B,C2J9J0.72
NLENORLEUCINEA,B,I4HVP0.72
NLENORLEUCINEA,B,C2AVM0.72
NLENORLEUCINEB,C1K1T0.72
NLENORLEUCINEA,B,C2AOC0.72
NLENORLEUCINEA,B,C2JE40.72
NLENORLEUCINEA,B,I3DCK0.72
NLENORLEUCINEB1EOL0.72
NLENORLEUCINEA1FF00.72
NLENORLEUCINEA1FG60.72
NLENORLEUCINEA1FGC0.72
NLENORLEUCINEE,S1Z3M0.72
NLENORLEUCINEA2RME0.72
NLENORLEUCINEB1FGL0.72
NLENORLEUCINEC1K1U0.72
NLENORLEUCINEA,B1B7H0.72
NLENORLEUCINEA1HTH0.72
NLENORLEUCINEA,B,D2J9K0.72
NLENORLEUCINEA2RMD0.72
NLENORLEUCINEA,B,C2AOG0.72
NLENORLEUCINEA2RMI0.72
NLENORLEUCINEI1EPO0.72
NLENORLEUCINEA1FFI0.72
NLENORLEUCINEA1HD90.72
NLENORLEUCINEA1FFF0.72
NLENORLEUCINEB2JND0.72
NLENORLEUCINEA1FEJ0.72
NLENORLEUCINEA2K9E0.72
NLENORLEUCINEC1CFN0.72
NLENORLEUCINEC1K2C0.72
NLENORLEUCINEA1WY40.72
NLENORLEUCINEA1FQ80.72
NLENORLEUCINEA,B1S1O0.72
NLENORLEUCINEA2F4K0.72
NLENORLEUCINEA,B1D5E0.72
NLENORLEUCINEA2JX40.72
NLENORLEUCINEA1FG80.72
NLENORLEUCINEA1WY30.72
NLENORLEUCINEI1YTJ0.72
NLENORLEUCINEA,B,I3DCR0.72
NLENORLEUCINEA,I2O400.72
NLENORLEUCINEA,B2GYP0.72
NLENORLEUCINEC,F1A8K0.72
NLENORLEUCINEC1BAI0.72
NLENORLEUCINEA,B2JT90.72
NLENORLEUCINEA2RM90.72
NLENORLEUCINEA,B1DAZ0.72
NLENORLEUCINEA1F3R0.72
NLENORLEUCINEA,I2JXR0.72
NLENORLEUCINEC,F1A940.72
NLENORLEUCINEA,B1S4A0.72
NLENORLEUCINEA1R9V0.72
NLENORLEUCINEA,B,C,D,E,F2Z2T0.72
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EKM0.72
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKJ0.72
DHH(S)-2-AMINO-7,7-DIHYDROXYHEPTANOIC ACIDA,B,C1T5F0.71