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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02428730

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVM0.81
2AO(2S)-2-AMINOHEXAN-1-OLA,I2O400.81
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOD0.81
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVQ0.81
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOC0.81
GE23,5-DIAMINO-CYCLOHEXANOLA1BYJ0.77
4HA4-HYDROXYBUTAN-1-AMINIUMA1S830.7
YTB(1R,2R,3S,4R,5R)-5-aminocyclopentane-
1,2,3,4-tetrol
A3DX30.81
THOREDUCED THREONINEA1SOC0.76
THOREDUCED THREONINEA2SOC0.76
AZK(S)-2-AMINO-6-AZIDOHEXANOIC ACIDA,B2AHP0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1FFF0.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B1EBK0.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLI1DS30.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K2B0.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K2C0.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B,C2AOE0.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1FG80.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1DW60.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLC,D2R9B0.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLB,C1K1T0.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B1DAZ0.75
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K1U0.75
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.71
GOO(1R,2R,3R,4S,5R)-4-amino-5-methoxycyclopentane-
1,2,3-triol
A3DX40.74
AOL(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE-
1,2,3,4-TETROL
A2F7Q0.81
IMRIMINORIBITOLA,B,C1I800.72
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.72
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.83
PA2PAROMOMYCIN (RING 2)B1O9M0.73
PA2PAROMOMYCIN (RING 2)A1PBR0.73