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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00417749

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CDX(S)-4,4'-(1-METHYL-1,2-ETHANEDIYL)BIS-
2,6-PIPERAZINEDIONE
A,B1QZR0.81
RIN3-AMINO-AZACYCLOTRIDECAN-2-ONEA,B1KBC0.71
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2EEP0.7
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2Z3Z0.7
GIOCYCLO-(GLYCINE-L-PROLINE) INHIBITORA,B1W1P0.72
SP7N-{(1S)-3-[(4-aminobutyl)amino]-
1-methylpropyl}acetamide
A,B3CNP0.77
SP5N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamideA,B3CND0.71
BUM2-AMINO-N,3,3-TRIMETHYLBUTANAMIDEA,B1GKC0.73
BUM2-AMINO-N,3,3-TRIMETHYLBUTANAMIDEA,B1GKD0.73
BAA(TERT-BUTYLOXYCARBONYL)-ALANYL-
ALANYL-AMINE
A1ELG0.73
A3M2-AMINO-3-METHYL-1-PYRROLIDIN-1-
YL-BUTAN-1-ONE
A,B1N1M0.75
PPLPIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE
A,B1IDB0.8
PPLPIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE
A,B1IDA0.8
MNVN-METHYL-C-AMINO VALINEC1CWJ0.72