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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00012392

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1FFF0.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B1EBK0.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLI1DS30.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K2B0.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K2C0.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B,C2AOE0.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1FG80.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLA1DW60.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLC,D2R9B0.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLB,C1K1T0.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLA,B1DAZ0.72
DCL2-AMINO-4-METHYL-PENTAN-1-OLC1K1U0.72
ETAETHANOLAMINEA,B1KQE0.73
ETAETHANOLAMINEA,B,C,D1W5U0.73
ETAETHANOLAMINEA,B,C,D2IZQ0.73
ETAETHANOLAMINEA,B1JO30.73
ETAETHANOLAMINEA,B1MAG0.73
ETAETHANOLAMINEA,B1NT60.73
ETAETHANOLAMINEA,B1JO40.73
ETAETHANOLAMINEA,B1ALX0.73
ETAETHANOLAMINEA,B1AL40.73
ETAETHANOLAMINEA,B,C,D1BYZ0.73
ETAETHANOLAMINEA,B1NG80.73
ETAETHANOLAMINEA,B,C,D1AV20.73
ETAETHANOLAMINEA1P4T0.73
ETAETHANOLAMINEA,B1NT50.73
ETAETHANOLAMINEA1AII0.73
ETAETHANOLAMINEA,B1NRM0.73
ETAETHANOLAMINEA,B1GRM0.73
ETAETHANOLAMINEA,B1JNO0.73
ETAETHANOLAMINEA,B1MIC0.73
ETAETHANOLAMINEA,B1NRU0.73
ETAETHANOLAMINEA,B3AL10.73
ETAETHANOLAMINEA,B,C,D1GMK0.73
ETAETHANOLAMINEA,B1BDW0.73
ETAETHANOLAMINEA,B1ALZ0.73
ETAETHANOLAMINEA,B,C,D1C4D0.73
VOLL-VALINOLA,B1M240.75
AZK(S)-2-AMINO-6-AZIDOHEXANOIC ACIDA,B2AHP0.7
SEL2-AMINO-1,3-PROPANEDIOLD1D5X0.74
4HA4-HYDROXYBUTAN-1-AMINIUMA1S831
THOREDUCED THREONINEA1SOC0.73
THOREDUCED THREONINEA2SOC0.73
FOP2-HYDROXY-PROPYL-AMMONIUMA1ID80.73
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVM0.74
2AO(2S)-2-AMINOHEXAN-1-OLA,I2O400.74
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOD0.74
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVQ0.74
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOC0.74
DYB4-(1,3,2-DIOXABOROLAN-2-YLOXY)BUTAN-
1-AMINIUM
A1S840.76