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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03090028

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3HD3-O-METHYL-O-ALPHA-D-MANNOPYRANOSYLA2HGO0.7
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B,C,D1VAQ0.73
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKH0.73
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKI0.73
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1D830.73
2IPD-MYO-INOSITOL-1,4-BISPHOSPHATEA1I9Z0.78
289D-glycero-alpha-D-manno-heptopyranoseA,B,C2RIA0.72
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEI,J,K,L,M,N,
O,P
1JZ10.72
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEA,B,C,D,E,F,
G,H
1JZ00.72
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEA,B,C,D1JZ20.72
AAL3,6-ANHYDRO-L-GALACTOSEA,B,C,D2CDO0.75
AAL3,6-ANHYDRO-L-GALACTOSEA,B1AGA0.75
AAL3,6-ANHYDRO-L-GALACTOSEA,B,C,D2CDP0.75
AAL3,6-ANHYDRO-L-GALACTOSEA1URX0.75
5IP(1R,2R,3R,4R,5S,6S)-6-HYDROXYCYCLOHEXANE-
1,2,3,4,5-PENTAYL PENTAKIS[DIHYDROGEN (PHOSPHATE)]
A2I5F0.74
3MG3-O-methyl-beta-D-glucopyranoseA2QW10.73
2DG2-DEOXY-BETA-D-GALACTOSEA,B,C,D1JZ30.75
2DG2-DEOXY-BETA-D-GALACTOSEA,B,C,D1JZ40.75
293(2S,4R,5S,6R)-6-((S)-1,2-dihydroxyethyl)tetrahydro-
2H-pyran-2,4,5-triol
A,B,C2RIE0.72
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1U270.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FAO0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA2UZS0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1H100.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R0D0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1B550.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1W1D0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1BWN0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1W2D0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1FHX0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R090.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UNQ0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UPR0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FGY0.74
2GS2-O-METHYL-ALPHA-D-GALACTOPYRANOSEA,B,C,D2DTW0.72
AFPALPHA FRUCTOSE 1,6-DIPHOSPHATEA,B1FBH0.98
AFPALPHA FRUCTOSE 1,6-DIPHOSPHATEA1LLC0.98
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE50.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
1Q9X0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NP70.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PM50.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B2OFI0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE40.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEU,X1DE80.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZS0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2NQ90.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2NP60.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1PHJ0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NQJ0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T2OZM0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N390.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N3A0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,V,Y1DE90.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2IH50.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,I2P5O0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZL0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,I2P5G0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1M5R0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1Y6F0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1P5W0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D9MHT0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6X0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6V0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PJJ0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCT0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6Y0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED2RBA0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1FN70.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEX1M060.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1P590.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEB,U,X1DEW0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT40.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C1QUM0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCW0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1IXY0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1N480.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,E,F,I,J,K2OYQ0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,F1OE60.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEE,G,I,K2DTU0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D,G,H1PH50.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT70.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,G3EI20.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,D,F1N560.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2IBT0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,D2P660.83
A5PARABINOSE-5-PHOSPHATEA1UJ60.77
A5PARABINOSE-5-PHOSPHATEA,B1FXQ0.77
A5PARABINOSE-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
2NX30.77
A5PARABINOSE-5-PHOSPHATEA,B1LRQ0.77
A5PARABINOSE-5-PHOSPHATEA,B2CXP0.77
A5PARABINOSE-5-PHOSPHATEA,B1T8X0.77
A5PARABINOSE-5-PHOSPHATEA,B2EF90.77
A5PARABINOSE-5-PHOSPHATEA,B1FY60.77
A5PARABINOSE-5-PHOSPHATEA,B2NWS0.77
A5PARABINOSE-5-PHOSPHATEA,B2NXG0.77
A5PARABINOSE-5-PHOSPHATEA,B2A2I0.77
A5PARABINOSE-5-PHOSPHATEA,B1FWW0.77
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9J0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPC,D1MTL0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPB,C2OYT0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1G5E0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPD1MWI0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9I0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1GJ00.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPB1SJL0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA2SSP0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9G0.88
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9H0.88
ABEABEQUOSEH,L1MFE0.73
ABEABEQUOSEH1MFA0.73
ABEABEQUOSEA,B,C2J600.73
ABEABEQUOSEH1MFC0.73
ABEABEQUOSEH1MFD0.73
ABEABEQUOSEH1MFB0.73
ABEABEQUOSEA1TYX0.73
A6P6-O-phosphono-alpha-D-allopyranoseA,B,C,D,E2VVO0.88
3PI(1S)-2-(1-HYDROXYBUTOXY)-1-{[(HYDROXY{[(2R,3S,5R,6S)-
2,4,6-TRIHYDROXY-3,5-BIS(PHOSPHONOOXY)CYCLOHEXYL]OXY}PHOSPHORYL)OXY]METHYL}ETHYL BUTYRATE
A1ZVR0.7
ABFBETA-D-ARABINOFURANOSE-5'-PHOSPHATEA,B,E,F1O8B0.9