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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03208329

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
KCQ(3S)-3-[(2S)-2-AMINO-3-OXOBUTYL]PYRROLIDIN-
2-ONE
A,I2Z3E0.71
ALJCYCLO-(L-ARGININE-L-PROLINE) INHIBITORA,B1W1V0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.73
CGN5-OXO-PYRROLIDINE-2-CARBALDEHYDEA3CAR0.77
CGN5-OXO-PYRROLIDINE-2-CARBALDEHYDEA1I3U0.77
CGN5-OXO-PYRROLIDINE-2-CARBALDEHYDEA3CAO0.77
LPDL-PROLINAMIDEH,S2H9E0.8
OHM3-OXO-N-[(3S)-2-OXOPYRROLIDIN-3-
YL]DODECANAMIDE
B,H2NTF0.76
DP9L-N(OMEGA)-NITROARGININE-(4R)-AMINO-
L-PROLINE AMIDE
A,B1ZZQ0.71
DP9L-N(OMEGA)-NITROARGININE-(4R)-AMINO-
L-PROLINE AMIDE
A,B1ZZS0.71
DP9L-N(OMEGA)-NITROARGININE-(4R)-AMINO-
L-PROLINE AMIDE
A,B1P6N0.71
DP9L-N(OMEGA)-NITROARGININE-(4R)-AMINO-
L-PROLINE AMIDE
A,B1ZZR0.71
DP9L-N(OMEGA)-NITROARGININE-(4R)-AMINO-
L-PROLINE AMIDE
A,B1ZZT0.71
DP9L-N(OMEGA)-NITROARGININE-(4R)-AMINO-
L-PROLINE AMIDE
A,B1P6J0.71
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2EEP0.77
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2Z3Z0.77
SNNL-3-AMINOSUCCINIMIDEA,B2IMZ0.77
SNNL-3-AMINOSUCCINIMIDEA,B3C030.77
SNNL-3-AMINOSUCCINIMIDEA3ESM0.77
SNNL-3-AMINOSUCCINIMIDEA,B2OMK0.77
SNNL-3-AMINOSUCCINIMIDEA1AT50.77
SNNL-3-AMINOSUCCINIMIDEA1JBE0.77
SNNL-3-AMINOSUCCINIMIDEA1WL80.77
BPR(2R)-N-[(2R)-2-(DIHYDROXYBORYL)-
1-L-PROLYLPYRROLIDIN-2-YL]-N-[(5R)-
5-(DIHYDROXYBORYL)-1-L-PROLYLPYRROLIDIN-
2-YL]-L-PROLINAMIDE
A,B,C,D2AJD0.79
GIOCYCLO-(GLYCINE-L-PROLINE) INHIBITORA,B1W1P0.76