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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03017861

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.9
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.9
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.9
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.9
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.9
NOJ1-DEOXYNOJIRIMYCINA,B2J770.9
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.9
NOJ1-DEOXYNOJIRIMYCINA3GBE0.9
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.9
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.9
NOJ1-DEOXYNOJIRIMYCINA1DOG0.9
NOJ1-DEOXYNOJIRIMYCINA,B1I750.9
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.9
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol
A,B2VL40.78
AZFAZAFAGOMINEA,B2J7H0.71
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.76
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.79
LOX3,4,5-TRIHYDOXY-PIPERIDINE-2-ONE-
OXIME
A1FH90.72
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.72
CGBCALYSTEGINE B2A,B2CBV0.76
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.79
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.78
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.72
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE
A2BWM0.73
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE
A1O9V0.73
15A(2Z,3R,4S,5R,6R)-2-[(2-aminoethyl)imino]-
6-(hydroxymethyl)piperidine-3,4,5-
triol
A,B2VQT0.7
YTB(1R,2R,3S,4R,5R)-5-aminocyclopentane-
1,2,3,4-tetrol
A3DX30.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1UP20.82
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D3GXF0.82
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCN0.82
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D2NSX0.82
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B1OIF0.82
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCQ0.82
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA2G9V0.82
EMP2,4-DIDEOXY-4-(ETHYLAMINO)-3-O-
METHYL ALPHA-L-THREO-PENTOPYRANOSIDE
A2PIK0.73
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.81
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.91
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.91
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.91
IMRIMINORIBITOLA,B,C1I800.81
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.79
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A2JCQ0.74
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B2IH90.74
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B,C,D,E,F2J2P0.74
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A3DIV0.74
MAT2,4-DIDEOXY-4-[2-(PROPYL)AMINO]-
3-O-METHYL ALPHA-L-THREO-PENTOPYRANOSIDE
A,B1PIK0.73
XIFPIPERIDINE-3,4-DIOLA1V0L0.89
XIFPIPERIDINE-3,4-DIOLA1V0N0.89
XIFPIPERIDINE-3,4-DIOLA1FH80.89
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A,B1UWU0.73
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A3D510.73
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A1U300.73
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
M1E720.73
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A,B2J780.73
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A1U2Y0.73
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
M,N1E6S0.73
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A2ALW0.78
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2J750.78
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A2V3G0.78
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL
A,B2VQU0.78
AOL(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE-
1,2,3,4-TETROL
A2F7Q0.71
NEB2-DEOXY-D-STREPTAMINEA1NEM0.72
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.76
OXZTETRAHYDROOXAZINEA,B1W3J0.73
OXZTETRAHYDROOXAZINEA1W3K0.73
OXZTETRAHYDROOXAZINEA1W3L0.73
2TB1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANEA2TOB0.71
GTL(2E,3R,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)-2-PIPERIDINONE
A,B2J790.73
GTL(2E,3R,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)-2-PIPERIDINONE
A,B1UWT0.73
17B(2Z,3R,4S,5R,6R)-2-[(4-aminobutyl)imino]-
6-(hydroxymethyl)piperidine-3,4,5-
triol
A,B2VR40.71
F34N-[(3S,4R,5R,6R)-4,5,6-trihydroxyazepan-
3-yl]acetamide
A,B2W670.71
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R
2HIL0.71
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A2HI20.71
PA2PAROMOMYCIN (RING 2)B1O9M0.73
PA2PAROMOMYCIN (RING 2)A1PBR0.73
CYY2-DEOXYSTREPTAMINEA1QD30.72
YRR3-HYDROXY-PYRROLIDIN-2-YLMETHYL-
MONOPHOSPHATE GROUP
A,D1F6O0.7
YRR3-HYDROXY-PYRROLIDIN-2-YLMETHYL-
MONOPHOSPHATE GROUP
D1BNK0.7
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC1