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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02510355

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5DP5-(2,5-dioxopyrrolidin-1-yl)-N-
[2-(2-{2-[(4-O-alpha-D-idopyranosyl-
alpha-D-mannopyranosyl)oxy]ethoxy}ethoxy)ethyl]pentanamide		A,B,C,D3CIU0.71
AH02-(2-ACETYLAMINO-4-HYDROXY-6,8-
DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)-
PROPIONIC ACID		A1QTE0.73
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E510.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1D0H0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1JOT0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LLP0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEX,Y2EAL0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1LU20.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,E,F2J3F0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LU10.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,F,G,H,I,
J,K,L,M		3EFX0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2VMC0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2W7Y0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1FNZ0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2W1U0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEF2JHI0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,C,E,G1M260.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2DTY0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2J1U0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2CCV0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2A2D0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2AYS0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2ZUT0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1KYJ0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2VNG0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2Z480.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSE1,2,31BCH0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2K330.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2IXB0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1ULF0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1JLX0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1AX00.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA30.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D1WMZ0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA60.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,G,H1LTI0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E7T0.78
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEN,O,P,Q,R,S,
T,U,V,W		2O2L0.78
A164-O-(4,6-dideoxy-4-{[(1S,2S,3S,4R,5S)-
2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-
alpha-D-glucopyranosyl)-beta-D-
glucopyranose 		A,B2VR50.83
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1CPU0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1NM90.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFV0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1PIG0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX1Z320.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFU0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3BLK0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX3BLP0.76
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3DHP0.76
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE		A3CUF0.86
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE		A,B2OYK0.86
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		A2QIR0.79
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE		A1ZT40.78
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE		A,C,E2PO60.78
AF14,6-dideoxy-4-{[(1S,4S,5S,6S)-4,5,6-
trihydroxy-3-(hydroxymethyl)cyclohex-
2-en-1-yl]amino}-beta-D-glucopyranose		A1BG90.75
3SAACARBOSE DERIVED TRISACCHARIDEA1XCW0.76
AB9(2R)-4-AMINO-N-{(1R,2S,3R,4R,5S)-
5-AMINO-2-{2-[(2-AMINOETHYL)AMINO]ETHOXY}-
4-[(2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-3-HYDROXYCYCLOHEXYL}-
2-HYDROXYBUTANAMIDE		A,D,M,N,Z2F4V0.73
AB9(2R)-4-AMINO-N-{(1R,2S,3R,4R,5S)-
5-AMINO-2-{2-[(2-AMINOETHYL)AMINO]ETHOXY}-
4-[(2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-3-HYDROXYCYCLOHEXYL}-
2-HYDROXYBUTANAMIDE		B2F4T0.73
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,D1I1D0.75
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2DKC0.75
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,C,D,E,F1NE70.75
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FS50.75
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2O280.75
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FRZ0.75
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1HOT0.75
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA2VXK0.75
AB6(2R)-4-AMINO-N-((1R,2S,3R,4R,5S)-
5-AMINO-4-[(2-AMINO-2-DEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-2-{2-[(3-
AMINOPROPYL)AMINO]ETHOXY}-3-HYDROXYCYCLOHEXYL)-
2-HYDROXYBUTANAMIDE		B2F4U0.75
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.77
ACGMODIFIED ACARBOSE PENTASACCHARIDEA,B1LWJ0.7
ABDACARBOSE DERIVED HEXASACCHARIDEA1QHO0.8
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL		A,B1NAA0.94
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL		A2AXR0.94
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL		A1W9X0.75
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL		A1B2Y0.75
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL		A1HX00.75
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL		A1OSE0.75
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside		A2RJ90.85
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside		A2RJ40.85
ACRACARBOSEA1MXD0.73
ACRACARBOSEA,B2ZQ00.73
ACRACARBOSEA2F6D0.73
ACRACARBOSEA,X2QMJ0.73
ACRACARBOSEA2OWC0.73
ACRACARBOSEA2OWW0.73
ACRACARBOSEA1GAH0.73
ACRACARBOSEA,B1K1Y0.73
ACRACARBOSEA,B1DED0.73
ACRACARBOSEA1ESW0.73
ACRACARBOSEA1AGM0.73
ACRACARBOSEA1MXG0.73
ACRACARBOSEA,B1LF90.73
ACRACARBOSEA,B2ECP0.73
ACRACARBOSEA1KXH0.73
ACRACARBOSEA1ULV0.73
ACRACARBOSEA3BC90.73