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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03075646

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PTOPSEUDOTROPINEA,B2AE20.71
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.81
LGS(3Z,5S,6R,7S,8R,8aR)-3-(octylimino)hexahydro[1,3]oxazolo[3,4-
a]pyridine-5,6,7,8-tetrol
A,B,C,D2WBG0.8
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.7
CTSCASTANOSPERMINEA1EQC1
CTSCASTANOSPERMINEA,B2JKP1
CTSCASTANOSPERMINEA,B,C2VL81
CTSCASTANOSPERMINEA,B2CBU1
CTSCASTANOSPERMINEA,B2PWG1
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A1HWW0.95
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A3BLB0.95
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.7
AM3(3Z,5S,6R,7S,8S,8aR)-3-(octylimino)hexahydro[1,3]oxazolo[3,4-
a]pyridine-5,6,7,8-tetrol
A,B,C,D2WC30.8
GHAA1TQU0.76
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.74
NOJ1-DEOXYNOJIRIMYCINA,B2J770.74
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.74
NOJ1-DEOXYNOJIRIMYCINA3GBE0.74
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.74
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.74
NOJ1-DEOXYNOJIRIMYCINA1DOG0.74
NOJ1-DEOXYNOJIRIMYCINA,B1I750.74
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.74
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.74
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.74
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.74
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.74
CGBCALYSTEGINE B2A,B2CBV0.78
3CUCASUARINEA,B,C,D2JJB0.81
3CUCASUARINEA3CTT0.81
AMF(3Z,5S,6R,7S,8R,8aS)-3-(octylimino)hexahydro[1,3]thiazolo[3,4-
a]pyridine-5,6,7,8-tetrol
A,B,C,D2WC40.72
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.7
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.84