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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03091880

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1TP80.7
AMGALPHA-METHYL-D-GALACTOSIDEA,B,C,D1BXH0.7
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1WS40.7
AMGALPHA-METHYL-D-GALACTOSIDEA,B,C,D,E,F,
G,H
1FAY0.7
AMGALPHA-METHYL-D-GALACTOSIDEA3CA50.7
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1UH10.7
AMGALPHA-METHYL-D-GALACTOSIDEA,B1F9K0.7
AMGALPHA-METHYL-D-GALACTOSIDEA,B2Z490.7
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1TOQ0.7
AMGALPHA-METHYL-D-GALACTOSIDEA,B,C,D1WBL0.7
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1JAC0.7
3MG3-O-methyl-beta-D-glucopyranoseA2QW10.72
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A,B1NAA0.75
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A2AXR0.75
3FM3-O-FORMAMIDO-ALPHA-D-MANNOPYRANOSIDEA1AO40.74
2GS2-O-METHYL-ALPHA-D-GALACTOPYRANOSEA,B,C,D2DTW0.71
293(2S,4R,5S,6R)-6-((S)-1,2-dihydroxyethyl)tetrahydro-
2H-pyran-2,4,5-triol
A,B,C2RIE0.71
2DG2-DEOXY-BETA-D-GALACTOSEA,B,C,D1JZ30.74
2DG2-DEOXY-BETA-D-GALACTOSEA,B,C,D1JZ40.74
ALLD-ALLOPYRANOSEA1RPJ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E510.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1D0H0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1JOT0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LLP0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEX,Y2EAL0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1LU20.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,E,F2J3F0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LU10.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,F,G,H,I,
J,K,L,M
3EFX0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2VMC0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2W7Y0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1FNZ0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2W1U0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEF2JHI0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,C,E,G1M260.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2DTY0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2J1U0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2CCV0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2A2D0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2AYS0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2ZUT0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1KYJ0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2VNG0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2Z480.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSE1,2,31BCH0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2K330.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2IXB0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1ULF0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1JLX0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1AX00.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA30.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D1WMZ0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA60.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,G,H1LTI0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E7T0.75
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEN,O,P,Q,R,S,
T,U,V,W
2O2L0.75
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ90.8
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ40.8
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B,C,D1VAQ0.72
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKH0.72
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKI0.72
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1D830.72
2TB1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANEA2TOB0.72
9CS(1R,2S,3S,4R,6S)-4,6-DIAMINO-3-
[(3-AMINO-3-DEOXY-ALPHA-D-GLUCOPYRANOSYL)OXY]-
2-HYDROXYCYCLOHEXYL 2,6-DIAMINO-
2,6-DIDEOXY-ALPHA-D-GLUCOPYRANOSIDE
A2QIR0.76
ABEABEQUOSEH,L1MFE0.72
ABEABEQUOSEH1MFA0.72
ABEABEQUOSEA,B,C2J600.72
ABEABEQUOSEH1MFC0.72
ABEABEQUOSEH1MFD0.72
ABEABEQUOSEH1MFB0.72
ABEABEQUOSEA1TYX0.72
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEI,J,K,L,M,N,
O,P
1JZ10.71
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEA,B,C,D,E,F,
G,H
1JZ00.71
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEA,B,C,D1JZ20.71
289D-glycero-alpha-D-manno-heptopyranoseA,B,C2RIA0.71
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1CPU0.97
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1NM90.97
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFV0.97
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1PIG0.97
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX1Z320.97
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFU0.97
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3BLK0.97
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX3BLP0.97
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3DHP0.97
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.93
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7Y0.92
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7X0.92
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R810.92
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7V0.92
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R800.92
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE
A3CUF0.71
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE
A,B2OYK0.71