Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03171285
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
DIY![]() | 5-BUTYLPIPERIDINE | C,D | 1A1E | 0.77 | ![]() |
GZZ![]() | N-{8-[(8-{[(E)-AMINO(IMINO)METHYL]AMINO}OCTYL)AMINO]OCTYL}GUANIDINE | A,B,C | 1H82 | 0.71 | ![]() |
HPL![]() | HEPTYLFORMAMIDE | A,B | 1U3V | 0.74 | ![]() |
GC7![]() | 1-GUANIDINIUM-7-AMINOHEPTANE | A,B | 1RQD | 0.8 | ![]() |
DIA![]() | OCTANE 1,8-DIAMINE | A,B | 3BI5 | 0.81 | ![]() |
DIA![]() | OCTANE 1,8-DIAMINE | A,B,C | 1H83 | 0.81 | ![]() |
297![]() | dodecane-1,12-diamine | A,B | 3BI2 | 0.81 | ![]() |
16D![]() | HEXANE-1,6-DIAMINE | A,B,C | 2QK9 | 0.71 | ![]() |
16D![]() | HEXANE-1,6-DIAMINE | A,B,C,D,E,F | 1WOG | 0.71 | ![]() |
B33![]() | N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE- 1,3-DIAMINE | A,B | 2B4B | 0.73 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A1B | 0.87 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A07 | 0.87 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A1A | 0.87 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A08 | 0.87 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A09 | 0.87 | ![]() |
10A![]() | DIDECYL-DIMETHYL-AMMONIUM | A,B,C,D | 1KPH | 0.74 | ![]() |
10A![]() | DIDECYL-DIMETHYL-AMMONIUM | A | 1KPI | 0.74 | ![]() |
FXY![]() | 1-METHYLHEPTYLFORMAMIDE | A,B | 1U3W | 0.73 | ![]() |
PIP![]() | PIPERIDINE | H | 1ETS | 0.76 | ![]() |
PIP![]() | PIPERIDINE | H | 1ETT | 0.76 | ![]() |
PIP![]() | PIPERIDINE | E,I | 1PPC | 0.76 | ![]() |
PIP![]() | PIPERIDINE | I | 1QUR | 0.76 | ![]() |
PIP![]() | PIPERIDINE | E | 1PPH | 0.76 | ![]() |
P24![]() | 1-(AMINOETHYL)AMINO-4-AMINOBUTANE | B | 1O9M | 0.73 | ![]() |
P24![]() | 1-(AMINOETHYL)AMINO-4-AMINOBUTANE | A,B | 292D | 0.73 | ![]() |
16A![]() | CETYL-TRIMETHYL-AMMONIUM | A | 3HF0 | 0.71 | ![]() |
16A![]() | CETYL-TRIMETHYL-AMMONIUM | A,B,C,D | 1KPG | 0.71 | ![]() |
16A![]() | CETYL-TRIMETHYL-AMMONIUM | A | 1TPY | 0.71 | ![]() |
2EP![]() | 2-ETHYLPIPERIDINE | H,I | 1A4W | 0.75 | ![]() |
DRE![]() | N-(6-AMINOHEXYL)HEXANE-1,6-DIAMINE | A,B | 1Z6L | 0.9 | ![]() |
CAT![]() | DODECANE-TRIMETHYLAMINE | A,B | 2SHP | 0.73 | ![]() |
NMH![]() | (R)-N-(1-METHYL-HEXYL)-FORMAMIDE | A,B,C,D | 1P1R | 0.7 | ![]() |
DIX![]() | METHYL(CYCLOPENTYL-PROPYL)AMINE | C,D | 1A1C | 0.76 | ![]() |