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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00485032

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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,D2AJD0.84
PPLPIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE
A,B1IDB0.72
PPLPIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE
A,B1IDA0.72
GIOCYCLO-(GLYCINE-L-PROLINE) INHIBITORA,B1W1P0.84
LPDL-PROLINAMIDEH,S2H9E0.94
CGN5-OXO-PYRROLIDINE-2-CARBALDEHYDEA3CAR0.75
CGN5-OXO-PYRROLIDINE-2-CARBALDEHYDEA1I3U0.75
CGN5-OXO-PYRROLIDINE-2-CARBALDEHYDEA3CAO0.75
PRIPYRROLIDINE-2-CARBALDEHYDEA,B,T1H4Q0.77
PRIPYRROLIDINE-2-CARBALDEHYDEA,B2J3M0.77
ALJCYCLO-(L-ARGININE-L-PROLINE) INHIBITORA,B1W1V0.73
MNVN-METHYL-C-AMINO VALINEC1CWJ0.75
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2EEP0.81
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2Z3Z0.81
NLNNORLEUCINE AMIDEA1DW60.7
NLNNORLEUCINE AMIDEA,B,C2AOE0.7
NLNNORLEUCINE AMIDEA,B1EBK0.7
OHM3-OXO-N-[(3S)-2-OXOPYRROLIDIN-3-
YL]DODECANAMIDE
B,H2NTF0.72
RIN3-AMINO-AZACYCLOTRIDECAN-2-ONEA,B1KBC0.73
A3M2-AMINO-3-METHYL-1-PYRROLIDIN-1-
YL-BUTAN-1-ONE
A,B1N1M0.78
BUM2-AMINO-N,3,3-TRIMETHYLBUTANAMIDEA,B1GKC0.72
BUM2-AMINO-N,3,3-TRIMETHYLBUTANAMIDEA,B1GKD0.72