Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02384085
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 |
NTN | ISONICOTINAMIDINE | A | 7ADH | 0.79 |  |
APY | 2-AMINOMETHYL-PYRIDINE | A,B,I | 1HIV | 0.74 | |
| APY | 2-AMINOMETHYL-PYRIDINE | I | 1IVP | 0.74 | |
OBI | 1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME | A,B | 2GYW | 0.75 | |
C4C | N-(4-chlorobenzyl)-N',N'-dimethyl- N-pyridin-2-ylethane-1,2-diamine | A | 2RA7 | 0.71 | |
3AP | 3-AMINOPYRIDINE | A | 1AEF | 0.72 | |
1BY | [2-(PYRIDIN-2-YLAMINO)ETHANE-1,1- DIYL]BIS(PHOSPHONIC ACID) | A,B | 2I19 | 0.8 | |
2AP | 2-AMINOPYRIDINE | A | 1AEO | 0.84 | |
BVF | 4-METHYLPYRIDIN-2-AMINE | A,B | 3E67 | 0.82 | |
| BVF | 4-METHYLPYRIDIN-2-AMINE | A | 2EUT | 0.82 | |
MPI | IMIDAZO[1,2-A]PYRIDINE | A | 1AEM | 0.71 | |
IMB | [(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO- METHYL]-PHOSPHONIC ACID | A,B | 1T1R | 0.72 | |
PY2 | 3-(MERCAPTOMETHYLENE)PYRIDINE | A,B | 1IDA | 0.74 | |
RW1 | 4-phenylpyrimidine | A,B,C | 3B9S | 0.7 | |
3MP | 3-METHYLPYRIDINE | A | 1EUB | 0.77 | |
| 3MP | 3-METHYLPYRIDINE | A | 1BM6 | 0.77 | |
D4G | A,B,C,D | 2FDY | 0.72 | | |
SB9 | HYDROXY[3-(6-METHYLPYRIDIN-2-YL)PROPYL]FORMAMIDE | P | 2AIE | 0.71 | |
1SQ | ISOQUINOLIN-1-AMINE | A | 2OHK | 0.76 | |
8AP | N~3~-BENZYLPYRIDINE-2,3-DIAMINE | A | 2OHM | 0.74 | |
286 | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.74 | |
CBQ | [(5-CHLORO-PYRIDIN-2-YLAMINO)-PHOSPHONO- METHYL]-PHOSPHONIC ACID | A,B | 1T1S | 0.76 | |
275 | 5-amino-1,2-dimethylpyridinium | X | 2RBW | 0.71 | |
GVH | 1H-PYRROLO[2,3-B]PYRIDINE | A | 2UVX | 0.7 | |
4AP | 4-AMINOPYRIDINE | A | 1AEG | 0.72 | |
HBP | 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME | A,B | 2GYV | 0.75 | |
| HBP | 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME | A,B | 2JF0 | 0.75 | |
PYS | 2-PYRIDINETHIOL | A,B | 1CTE | 0.74 | |
| PYS | 2-PYRIDINETHIOL | A | 2IPP | 0.74 | |
LG4 | 5-METHYLPYRIDIN-2-AMINE | A | 2EUP | 0.83 | |
NI9 | 3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A | 2OPM | 0.71 | |
| NI9 | 3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 3DYF | 0.71 | |
| NI9 | 3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 3DYG | 0.71 | |
DA1 | PYRIDINE-2,5-DIAMINE | A | 2AQD | 0.83 | |
26D | PYRIDINE-2,6-DIAMINE | A | 2ANZ | 0.79 | |
1PS | 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE | A,B,C,D | 2RFQ | 0.73 | |
| 1PS | 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE | A,B,C,D,E,F | 2GA4 | 0.73 | |
| 1PS | 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE | A,B,C,D,E,F | 1R4P | 0.73 | |
SPY | 4-HYDROSULFONYLPYRIDINE | A,B | 1IDB | 0.74 | |