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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02310418

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BGTTERT-BUTYL D-ALPHA-GLUTAMINATEA,B2AFU0.72
LEF(4S)-5-FLUORO-L-LEUCINEA1OGW0.7
AC51-AMINOCYCLOPENTANECARBOXYLIC ACIDA,B1Y1M0.73
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA,B,C2OXJ0.74
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA2OXK0.74
C5B(1S,3R)-1-AMINOCYCLOPENTANE-1,3-
DICARBOXYLIC ACID
A,B2E4X0.73
C5A(1S,3S)-1-aminocyclopentane-1,3-
dicarboxylic acid
A,B2E4W0.73
LME(3R)-3-METHYL-L-GLUTAMIC ACIDA1XT70.71
DMOALPHA-DIFLUOROMETHYLORNITHINEA,B,C,D2TOD0.77
SYM2S,4R-4-METHYLGLUTAMATEA,B1SD30.74
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
LED(4R)-5-OXO-L-LEUCINEA2IUW0.73
DGND-GLUTAMINEA,D2Q3I0.83
DGND-GLUTAMINEA,L1ZEA0.83
DGND-GLUTAMINEA,B2FCM0.83
DGND-GLUTAMINEA1BFW0.83
DGND-GLUTAMINEE1EPR0.83
DGND-GLUTAMINEA2JX40.83
DGND-GLUTAMINEA,B,C,D2R3C0.83
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.83
DGND-GLUTAMINEA,B2Q330.83
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.83
DGND-GLUTAMINEA,B,C1YJ10.83
DGND-GLUTAMINEA1B740.83
GAMALPHA-METHYL-L-GLUTAMIC ACIDA,B1BJO0.83
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5N0.71
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5M0.71
HGAGLUTAMINE HYDROXAMATEA,B1XFG0.78
MEQN5-METHYLGLUTAMINEA,B1NV80.77
2ML2-METHYLLEUCINEA,B,C1I1L0.8
2ML2-METHYLLEUCINEA2RM90.8
2ML2-METHYLLEUCINEA2RMD0.8
ORNORNITHINEE1LAH0.74
ORNORNITHINEB,C,E,F,H,I,
K,L
1JDB0.74
ORNORNITHINEA,Y1TK20.74
ORNORNITHINEA,B,C2W6U0.74
ORNORNITHINEA1T5M0.74
ORNORNITHINEA,B,C,D,E,G,H1BXR0.74
ORNORNITHINEA,B,C,D,E,F,
G,H
1KEE0.74
ORNORNITHINEA,B,C1HQG0.74
ORNORNITHINEA,B,C2W6T0.74
ORNORNITHINEA,B1X7D0.74
ORNORNITHINEA1T5N0.74
ORNORNITHINEA,B,C,D,E,F,
G,H
1CE80.74
ORNORNITHINEA1DSR0.74
ORNORNITHINEA,B,C,D,E,F,
G,H
1A9X0.74
ORNORNITHINEH,K,L,M,P,R1N0X0.74
ORNORNITHINEA,B2PM50.74
ORNORNITHINEA,B,C,D,E,F,
G,H
1CS00.74
ORNORNITHINEE,I1QR30.74
ORNORNITHINEA1HTH0.74
ORNORNITHINEA,B,C,D,E,F,
G,H
1M6V0.74
ORNORNITHINEA,B,C,D,E,F,
G,H
1C3O0.74
ORNORNITHINEA,B,C,D,E,F,
G,H
1C300.74
ORNORNITHINEA1XT70.74
ORNORNITHINEA3JDW0.74
ORNORNITHINEA,B,C,D,E,F,
G,H
1T360.74
ORNORNITHINEA,B1B2H0.74
ORNORNITHINEA,B,C,D,E,F4CEV0.74
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBM1
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBN1
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBU1
MGN2-METHYL-GLUTAMINEA,B,C,D,E,F1HBO1
MGN2-METHYL-GLUTAMINEA,C,D,F1MRO1
DIVD-ISOVALINEA1IH90.72
DIVD-ISOVALINEA1DLZ0.72
DIVD-ISOVALINEA1OB40.72
DIVD-ISOVALINEA,B1JOH0.72
DIVD-ISOVALINEA1EE70.72
DIVD-ISOVALINEA,B1OB60.72
DIVD-ISOVALINEA1GQ00.72
DIVD-ISOVALINEA1OB70.72
DIVD-ISOVALINEA1R9U0.72
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA,B,C,D2APH0.79
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDB2FCI0.79
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA1B9U0.79
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA,P1TWQ0.79
1921-AMINOCYCLOBUTANECARBOXLIC ACIDA1Y1Z0.75
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.72
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.72