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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01727730

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
IABISO-ACARBOSEA1XCX0.77
GACDIHYDRO-ACARBOSEA1GAI0.72
DR36-DEOXY-ALPHA-L-GLUCOPYRANOSYL-
(1->2)-BETA-D-GULOPYRANOSYL-(1-
>3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]-
ALPHA-L-TALOPYRANOSE		A1ZJ20.72
DR36-DEOXY-ALPHA-L-GLUCOPYRANOSYL-
(1->2)-BETA-D-GULOPYRANOSYL-(1-
>3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]-
ALPHA-L-TALOPYRANOSE		A1ZI50.72
HYGHYGROMYCIN BA,E,N3DF10.73
HYGHYGROMYCIN BA,E3DF30.73
HYGHYGROMYCIN BA,D,H,N1HNZ0.73
AM2APRAMYCINB2OE80.74
AM2APRAMYCINA,B2OE50.74
AM2APRAMYCINA,B1YRJ0.74
AM2APRAMYCINA,B2G5K0.74
CNY13,15-DIAMINO-2-(AMINOMETHYL)-3,4,9,12-
TETRAHYDROXYHEXADECAHYDRO-2H-7,10-
EPOXYPYRANO[2,3-B][1,10,4]BENZODIOXAZACYCLODODECIN-
8-YL 2,6-DIAMINO-2,6-DIDEOXYHEXOPYRANOSIDE		A,C,D1ZZ50.75
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
AAOACARBOSE DERIVED HEXASACCHARIDEA1XH00.73
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,B2VR50.74
3SAACARBOSE DERIVED TRISACCHARIDEA1XCW0.79
ABCMODIFIED ACARBOSE HEXASACCHARIDEA7TAA0.73
ACRACARBOSEA1MXD0.77
ACRACARBOSEA,B2ZQ00.77
ACRACARBOSEA2F6D0.77
ACRACARBOSEA,X2QMJ0.77
ACRACARBOSEA2OWC0.77
ACRACARBOSEA2OWW0.77
ACRACARBOSEA1GAH0.77
ACRACARBOSEA,B1K1Y0.77
ACRACARBOSEA,B1DED0.77
ACRACARBOSEA1ESW0.77
ACRACARBOSEA1AGM0.77
ACRACARBOSEA1MXG0.77
ACRACARBOSEA,B1LF90.77
ACRACARBOSEA,B2ECP0.77
ACRACARBOSEA1KXH0.77
ACRACARBOSEA1ULV0.77
ACRACARBOSEA3BC90.77
AREACARBOSE DERIVED PENTASACCHARIDEA3BAY0.74
AREACARBOSE DERIVED PENTASACCHARIDEA1XH20.74
AREACARBOSE DERIVED PENTASACCHARIDEA1XD00.74
AREACARBOSE DERIVED PENTASACCHARIDEA3BAJ0.74
ACGMODIFIED ACARBOSE PENTASACCHARIDEA,B1LWJ0.74
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		A2QIR0.73
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE		A2GJP0.71
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE		A1G9H0.71
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE		A1BG90.71
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE		A1PPI0.71
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE		A1RP90.71
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE		A1G940.71
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE		A1RPK0.71
HS22-deoxy-4-O-(4-deoxy-alpha-L-threo-
hex-4-enopyranuronosyl)-2-{[(1R)-
1-hydroxyethyl]amino}-alpha-D-glucopyranose		A,B,C3E800.72
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
6SAACARBOSE DERIVED HEXASACCHARIDEA1XD10.73
GETGENETICINA1MWL0.81
GETGENETICINA,B,C,D1NJJ0.81