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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03029147

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
COR2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANEA9HVP0.75
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.75
2NAnaphthalen-2-ylmethanolA,B,C3EE50.72
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.71
IOB3-IODO-BENZYL ALCOHOLA,B1QK00.71
341(3,5-difluorophenyl)methanolC3EON0.75
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.76
IPB5-METHYL-2-(1-METHYLETHYL)PHENOLA,B1E060.7
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B1QV70.76
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B,C,D1MG00.76
12M(2-ETHYLPHENYL)METHANOLA,B2F620.76
ALEL-EPINEPHRINEA3PAH0.7
ALEL-EPINEPHRINEA2HKK0.7
HPHPHENYLALANINDIOLI1E5O0.75
HPHPHENYLALANINDIOLA,B1ODX0.75
HPHPHENYLALANINDIOLA,B1MTB0.75
HPHPHENYLALANINDIOLA,B2FGV0.75
HPHPHENYLALANINDIOLA1ODW0.75
HPHPHENYLALANINDIOLA,B2FGU0.75
HPHPHENYLALANINDIOLA,B1HXB0.75
CTLCIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-
1-OL
A,B2AN30.83
4BZ4-(HYDROXYMETHYL)BENZAMIDINEA1S6H0.76
AEF4-(2-aminoethyl)phenolA3BRA0.74
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.74
APLN-(1-BENZYL-3,3,3-TRIFLUORO-2,2-
DIHYDROXY-PROPYL)-ACETAMIDE
B,C1GG60.71
24B(2,4-DIFLUOROPHENYL)METHANOLA,B1QV60.76
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.73
AHT4-(2,5-DIAMINO-5-HYDROXY-PENTYL)-
PHENOL
I,T1TMB0.75