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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02366302

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4HA4-HYDROXYBUTAN-1-AMINIUMA1S830.74
DTHD-THREONINEA1KRO0.71
DTHD-THREONINEA,B,C,D3BOG0.71
DTHD-THREONINEA,B173D0.71
DTHD-THREONINEA209D0.71
DTHD-THREONINEA316D0.71
DTHD-THREONINEA,B2Q330.71
DTHD-THREONINEA2JUE0.71
DTHD-THREONINEA2D550.71
ETAETHANOLAMINEA,B1KQE0.72
ETAETHANOLAMINEA,B,C,D1W5U0.72
ETAETHANOLAMINEA,B,C,D2IZQ0.72
ETAETHANOLAMINEA,B1JO30.72
ETAETHANOLAMINEA,B1MAG0.72
ETAETHANOLAMINEA,B1NT60.72
ETAETHANOLAMINEA,B1JO40.72
ETAETHANOLAMINEA,B1ALX0.72
ETAETHANOLAMINEA,B1AL40.72
ETAETHANOLAMINEA,B,C,D1BYZ0.72
ETAETHANOLAMINEA,B1NG80.72
ETAETHANOLAMINEA,B,C,D1AV20.72
ETAETHANOLAMINEA1P4T0.72
ETAETHANOLAMINEA,B1NT50.72
ETAETHANOLAMINEA1AII0.72
ETAETHANOLAMINEA,B1NRM0.72
ETAETHANOLAMINEA,B1GRM0.72
ETAETHANOLAMINEA,B1JNO0.72
ETAETHANOLAMINEA,B1MIC0.72
ETAETHANOLAMINEA,B1NRU0.72
ETAETHANOLAMINEA,B3AL10.72
ETAETHANOLAMINEA,B,C,D1GMK0.72
ETAETHANOLAMINEA,B1BDW0.72
ETAETHANOLAMINEA,B1ALZ0.72
ETAETHANOLAMINEA,B,C,D1C4D0.72
FOP2-HYDROXY-PROPYL-AMMONIUMA1ID80.88
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
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVM0.77
2AO(2S)-2-AMINOHEXAN-1-OLA,I2O400.77
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOD0.77
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVQ0.77
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOC0.77
PY0(1S,2S)-1-amino-1,2-dihydroxypropan-
1-olate
A,B,C,D2W930.7
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
A1E9W0.73
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
B1OLN0.73
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
C2JQ70.73
VOLL-VALINOLA,B1M240.83
SEL2-AMINO-1,3-PROPANEDIOLD1D5X0.82
ALTTHIOALANINEC,D1VBT0.71
ALOALLO-THREONINEI,P1HDT0.71
ALOALLO-THREONINEA2JUU0.71
ALOALLO-THREONINEA2VMX0.71
THOREDUCED THREONINEA1SOC0.91
THOREDUCED THREONINEA2SOC0.91