Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00020603
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 |
4ND | N4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINE | H,I | 1NO9 | 0.77 | |
PHZ | 1-PHENYLHYDRAZINE | A | 2E2T | 0.77 | |
PHZ | 1-PHENYLHYDRAZINE | D,H | 2AGL | 0.77 | |
PL0 | 1-phenylguanidine | A | 2O8W | 0.8 | |
PH3 | N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINE | A,B | 1DM6 | 0.7 | |
1AN | 2-FLUOROANILINE | A | 1LGW | 0.74 | |
5AN | 3,5-DIFLUOROANILINE | A | 1LGX | 0.72 | |
URS | N-PHENYLTHIOUREA | A,B | 1BUG | 0.89 | |
MPX | 4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDE | A | 1ZH9 | 0.72 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.74 | |
ANL | ANILINE | A | 2OV4 | 0.71 | |
ANL | ANILINE | A | 1AEE | 0.71 | |
ANL | ANILINE | A | 1PPA | 0.71 | |
ANL | ANILINE | A | 1HJ9 | 0.71 | |
264 | (phenylamino)acetonitrile | A | 2RBN | 0.74 | |
CIU | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A,B | 1EK1 | 0.71 | |
CIU | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A | 1VJ5 | 0.71 | |
BSU | 1,3-DIPHENYLUREA | A | 3E85 | 0.77 | |
BSU | 1,3-DIPHENYLUREA | A | 2ZJF | 0.77 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.76 | |
PHJ | N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE | A,B | 1UR9 | 0.73 |