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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02366321

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GE23,5-DIAMINO-CYCLOHEXANOLA1BYJ0.74
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.7
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1FFF0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B1EBK0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLI1DS30.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K2B0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K2C0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B,C2AOE0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1FG80.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1DW60.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLC,D2R9B0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLB,C1K1T0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B1DAZ0.77
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K1U0.77
SEL2-AMINO-1,3-PROPANEDIOLD1D5X0.7
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVM0.88
2AO(2S)-2-AMINOHEXAN-1-OLA,I2O400.88
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOD0.88
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVQ0.88
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOC0.88
THOREDUCED THREONINEA1SOC0.83
THOREDUCED THREONINEA2SOC0.83
PA2PAROMOMYCIN (RING 2)B1O9M0.71
PA2PAROMOMYCIN (RING 2)A1PBR0.71
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.73
4HA4-HYDROXYBUTAN-1-AMINIUMA1S830.72
FOP2-HYDROXY-PROPYL-AMMONIUMA1ID80.74
LOLLEUCINOLC,D2ZHR0.7
LOLLEUCINOLC,D1FKN0.7
LOLLEUCINOLC,D1M4H0.7
VOLL-VALINOLA,B1M240.76
AZK(S)-2-AMINO-6-AZIDOHEXANOIC ACIDA,B2AHP0.79