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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03404845

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.71
GHAA1TQU0.72
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol
A,B2VL40.7
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.71
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.83
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.83
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.83
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.83
HQ6N-[(3R,4S,5R,6R,7R)-3,5,6-trihydroxy-
7-(hydroxymethyl)azepan-4-yl]acetamide
A,B2W660.72
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.83
NOJ1-DEOXYNOJIRIMYCINA,B2J770.83
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.83
NOJ1-DEOXYNOJIRIMYCINA3GBE0.83
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.83
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.83
NOJ1-DEOXYNOJIRIMYCINA1DOG0.83
NOJ1-DEOXYNOJIRIMYCINA,B1I750.83
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.83
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A1HWW0.72
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A3BLB0.72
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.73
AOL(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE-
1,2,3,4-TETROL
A2F7Q0.74
CGBCALYSTEGINE B2A,B2CBV0.9
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.87
IMRIMINORIBITOLA,B,C1I800.87
YRR3-HYDROXY-PYRROLIDIN-2-YLMETHYL-
MONOPHOSPHATE GROUP
A,D1F6O0.76
YRR3-HYDROXY-PYRROLIDIN-2-YLMETHYL-
MONOPHOSPHATE GROUP
D1BNK0.76
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B,C,D,E,F1NE70.71
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA2ZJ40.71
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA1MOS0.71
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B1HOR0.71
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A2ALW0.7
H4P1-DEOXY-6-O-PHOSPHONO-1-[(PHOSPHONOMETHYL)AMINO]-
L-THREO-HEXITOL
A,B1PCW0.71
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2J750.7
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A2V3G0.7
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2VQU0.7
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.74
YTB(1R,2R,3S,4R,5R)-5-aminocyclopentane-
1,2,3,4-tetrol
A3DX30.74
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.93
NEB2-DEOXY-D-STREPTAMINEA1NEM0.72
M6R5-AMINO-5-DEOXY-1-O-PHOSPHONO-D-
MANNITOL
A,B,C,D2PUV0.71
2TB1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANEA2TOB0.71
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.83
CTSCASTANOSPERMINEA1EQC0.76
CTSCASTANOSPERMINEA,B2JKP0.76
CTSCASTANOSPERMINEA,B,C2VL80.76
CTSCASTANOSPERMINEA,B2CBU0.76
CTSCASTANOSPERMINEA,B2PWG0.76
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.93
CYY2-DEOXYSTREPTAMINEA1QD30.72
3CUCASUARINEA,B,C,D2JJB0.79
3CUCASUARINEA3CTT0.79