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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03202006

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LDO6-HYDROXY-L-NORLEUCINEA,B,C,D1JSR0.7
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.7
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.7
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.7
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.7
2ML2-METHYLLEUCINEA,B,C1I1L0.73
2ML2-METHYLLEUCINEA2RM90.73
2ML2-METHYLLEUCINEA2RMD0.73
6CL6-CARBOXYLYSINEU2AIZ0.7
1921-AMINOCYCLOBUTANECARBOXLIC ACIDA1Y1Z0.71
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HOZ0.72
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP20.72
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP10.72
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
UN12-AMINOHEXANEDIOIC ACIDA,B,C,D1H0G0.73
LEF(4S)-5-FLUORO-L-LEUCINEA1OGW0.72
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.7
API2,6-DIAMINOPIMELIC ACIDA2DAP0.7
API2,6-DIAMINOPIMELIC ACIDE,S148L0.7
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
AC51-AMINOCYCLOPENTANECARBOXYLIC ACIDA,B1Y1M0.75
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
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3HF00.7
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA,B,D,E,F3FDM0.7
XCP(1S,2S)-2-aminocyclopentanecarboxylic acidA3C3H0.7
ORNORNITHINEE1LAH0.8
ORNORNITHINEB,C,E,F,H,I,
K,L
1JDB0.8
ORNORNITHINEA,Y1TK20.8
ORNORNITHINEA,B,C2W6U0.8
ORNORNITHINEA1T5M0.8
ORNORNITHINEA,B,C,D,E,G,H1BXR0.8
ORNORNITHINEA,B,C,D,E,F,
G,H
1KEE0.8
ORNORNITHINEA,B,C1HQG0.8
ORNORNITHINEA,B,C2W6T0.8
ORNORNITHINEA,B1X7D0.8
ORNORNITHINEA1T5N0.8
ORNORNITHINEA,B,C,D,E,F,
G,H
1CE80.8
ORNORNITHINEA1DSR0.8
ORNORNITHINEA,B,C,D,E,F,
G,H
1A9X0.8
ORNORNITHINEH,K,L,M,P,R1N0X0.8
ORNORNITHINEA,B2PM50.8
ORNORNITHINEA,B,C,D,E,F,
G,H
1CS00.8
ORNORNITHINEE,I1QR30.8
ORNORNITHINEA1HTH0.8
ORNORNITHINEA,B,C,D,E,F,
G,H
1M6V0.8
ORNORNITHINEA,B,C,D,E,F,
G,H
1C3O0.8
ORNORNITHINEA,B,C,D,E,F,
G,H
1C300.8
ORNORNITHINEA1XT70.8
ORNORNITHINEA3JDW0.8
ORNORNITHINEA,B,C,D,E,F,
G,H
1T360.8
ORNORNITHINEA,B1B2H0.8
ORNORNITHINEA,B,C,D,E,F4CEV0.8
NVANORVALINEB,C1CA80.71
NVANORVALINEB,C,D1BA80.71
NVANORVALINEA1C9Y0.71
NVANORVALINEA,D2BTE0.71
NVANORVALINEA1OBH0.71
NVANORVALINEE,S1Z3P0.71
NVANORVALINEA1ZNM0.71
NVANORVALINEA1JDX0.71
NVANORVALINEA1FB50.71
NVANORVALINEA1OBC0.71
NVANORVALINE11YYY0.71
NVANORVALINEA,B1B6H0.71
NVANORVALINEA,B1ZZZ0.71
NVANORVALINEA,B,C2I6U0.71
NVANORVALINEB,C1BB00.71
NVANORVALINEE,S1Z3M0.71
DMOALPHA-DIFLUOROMETHYLORNITHINEA,B,C,D2TOD0.82
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.71
PB13-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACIDA,B1PV80.7
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
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBM0.75
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBN0.75
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBU0.75
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBO0.75
MGN2-METHYL-GLUTAMINEA,C,D,F1MRO0.75
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.7
DNED-NORLEUCINEA1R9V0.72
DNED-NORLEUCINEA,B1S4A0.72
DNED-NORLEUCINEA,B1S1O0.72
DAVDELTA-AMINO VALERIC ACIDA1H7O0.74
DAVDELTA-AMINO VALERIC ACIDA7JDW0.74
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
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.7
CHGCYCLOHEXYL-GLYCINEH,I4THN0.7
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.7
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.7
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
DGND-GLUTAMINEA,D2Q3I0.73
DGND-GLUTAMINEA,L1ZEA0.73
DGND-GLUTAMINEA,B2FCM0.73
DGND-GLUTAMINEA1BFW0.73
DGND-GLUTAMINEE1EPR0.73
DGND-GLUTAMINEA2JX40.73
DGND-GLUTAMINEA,B,C,D2R3C0.73
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.73
DGND-GLUTAMINEA,B2Q330.73
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.73
DGND-GLUTAMINEA,B,C1YJ10.73
DGND-GLUTAMINEA1B740.73
DILD-ISOLEUCINEA,B2Q330.75
DILD-ISOLEUCINEA1CWZ0.75
DILD-ISOLEUCINEA1CVQ0.75
DILD-ISOLEUCINEA1C4B0.75
DILD-ISOLEUCINEA1CW80.75
DILD-ISOLEUCINEA2AP80.75
IILISO-ISOLEUCINEA,B,C,D1Q4V0.75
IILISO-ISOLEUCINEA1KMF0.75
IILISO-ISOLEUCINEA,B,C1TGG0.75
IILISO-ISOLEUCINEA1RH40.75