Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02337325
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 |
PXY![]() | PARA-XYLENE | A | 187L | 0.7 | ![]() |
PXY![]() | PARA-XYLENE | A | 225L | 0.7 | ![]() |
FPR![]() | PROPYLBENZENE | C | 1RHK | 0.73 | ![]() |
BZQ![]() | DIPHENYLMETHANONE | A,B | 1GT5 | 0.8 | ![]() |
BZQ![]() | DIPHENYLMETHANONE | A,B | 1DZP | 0.8 | ![]() |
1LP![]() | TRANYLCYPROMINE | A,B | 1OJB | 0.79 | ![]() |
NPY![]() | NAPHTHALENE | A,B | 1O7G | 0.72 | ![]() |
DEN![]() | INDENE | A | 183L | 0.72 | ![]() |
3PL![]() | 3-PHENYLPROPANAL | E | 1Y3G | 0.82 | ![]() |
I4B![]() | ISOBUTYLBENZENE | A | 184L | 0.73 | ![]() |
9TA![]() | 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE | A,B | 1FDG | 0.73 | ![]() |
AC0![]() | 1-PHENYLETHANONE | A | 1ZK1 | 0.74 | ![]() |
AC0![]() | 1-PHENYLETHANONE | A | 1ZK4 | 0.74 | ![]() |
PYL![]() | PHENYLETHANE | C | 1B07 | 0.73 | ![]() |
PYL![]() | PHENYLETHANE | A,B | 2VRM | 0.73 | ![]() |
PYL![]() | PHENYLETHANE | A | 1NHB | 0.73 | ![]() |
CVB![]() | 4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID | A,B | 1KE0 | 0.71 | ![]() |
N4B![]() | N-BUTYLBENZENE | A | 186L | 0.73 | ![]() |
GW5![]() | (2E)-3-{4-[(1E)-1,2-DIPHENYLBUT- 1-ENYL]PHENYL}ACRYLIC ACID | A,B,C | 1R5K | 0.74 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | D,H | 2I0S | 0.81 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.81 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.81 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.81 | ![]() |
HY1![]() | PHENYLACETALDEHYDE | A,B | 1D6U | 0.81 | ![]() |
OXE![]() | ORTHO-XYLENE | A,B | 3E0X | 0.71 | ![]() |
OXE![]() | ORTHO-XYLENE | A | 188L | 0.71 | ![]() |
1PB![]() | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.78 | ![]() |
TCA![]() | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE6 | 0.72 | ![]() |
TCA![]() | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE8 | 0.72 | ![]() |
TCA![]() | PHENYLETHYLENECARBOXYLIC ACID | A,B,C,D,E,F, G,H | 2O78 | 0.72 | ![]() |
BDB![]() | A,B | 1KE3 | 0.76 | ![]() | |
HBX![]() | benzaldehyde | A,B | 3GDN | 0.78 | ![]() |
PBA![]() | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.73 | ![]() |
LEG![]() | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.74 | ![]() |
BP4![]() | BIPHENYL-4-YL-ACETALDEHYDE | A,B,E,F,G,H | 1MHW | 0.84 | ![]() |