Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03266899
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 |
C53![]() | 2-IMINO-5-(1-PYRIDIN-2-YL-METH- (E)-YLIDENE)-1,3-THIAZOLIDIN-4- ONE | A | 2V0D | 0.78 | ![]() |
LG4![]() | 5-METHYLPYRIDIN-2-AMINE | A | 2EUP | 0.73 | ![]() |
ESP![]() | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | B | 1C5Y | 0.76 | ![]() |
ESP![]() | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | A | 1C5U | 0.76 | ![]() |
ESP![]() | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | A | 1C5T | 0.76 | ![]() |
3MP![]() | 3-METHYLPYRIDINE | A | 1EUB | 0.75 | ![]() |
3MP![]() | 3-METHYLPYRIDINE | A | 1BM6 | 0.75 | ![]() |
PYS![]() | 2-PYRIDINETHIOL | A,B | 1CTE | 0.82 | ![]() |
PYS![]() | 2-PYRIDINETHIOL | A | 2IPP | 0.82 | ![]() |
2AP![]() | 2-AMINOPYRIDINE | A | 1AEO | 0.75 | ![]() |
275![]() | 5-amino-1,2-dimethylpyridinium | X | 2RBW | 0.72 | ![]() |
11X![]() | N-(pyridin-3-ylmethyl)aniline | A | 3EJ0 | 0.71 | ![]() |
HBP![]() | 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME | A,B | 2GYV | 0.71 | ![]() |
HBP![]() | 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME | A,B | 2JF0 | 0.71 | ![]() |
SPY![]() | 4-HYDROSULFONYLPYRIDINE | A,B | 1IDB | 0.83 | ![]() |
3AP![]() | 3-AMINOPYRIDINE | A | 1AEF | 0.73 | ![]() |
DA1![]() | PYRIDINE-2,5-DIAMINE | A | 2AQD | 0.73 | ![]() |
NTN![]() | ISONICOTINAMIDINE | A | 7ADH | 0.8 | ![]() |
286![]() | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.73 | ![]() |
U73![]() | N-(5-ISOPROPYL-THIAZOL-2-YL)-2- PYRIDIN-3-YL-ACETAMIDE | A | 2BTR | 0.72 | ![]() |
PY2![]() | 3-(MERCAPTOMETHYLENE)PYRIDINE | A,B | 1IDA | 0.76 | ![]() |
D4G![]() | A,B,C,D | 2FDY | 0.82 | ![]() | |
BVF![]() | 4-METHYLPYRIDIN-2-AMINE | A,B | 3E67 | 0.74 | ![]() |
BVF![]() | 4-METHYLPYRIDIN-2-AMINE | A | 2EUT | 0.74 | ![]() |
OBI![]() | 1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME | A,B | 2GYW | 0.71 | ![]() |
4AP![]() | 4-AMINOPYRIDINE | A | 1AEG | 0.75 | ![]() |
APY![]() | 2-AMINOMETHYL-PYRIDINE | A,B,I | 1HIV | 0.76 | ![]() |
APY![]() | 2-AMINOMETHYL-PYRIDINE | I | 1IVP | 0.76 | ![]() |
1PS![]() | 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE | A,B,C,D | 2RFQ | 0.75 | ![]() |
1PS![]() | 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE | A,B,C,D,E,F | 2GA4 | 0.75 | ![]() |
1PS![]() | 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE | A,B,C,D,E,F | 1R4P | 0.75 | ![]() |