Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02595187
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 |
5AN | 3,5-DIFLUOROANILINE | A | 1LGX | 0.75 | |
APB | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.7 | |
RJ1 | N-[2-chloro-5-(trifluoromethyl)phenyl]imidodicarbonimidic diamide | A,B,C,D | 3DGA | 0.7 | |
CIU | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A,B | 1EK1 | 0.78 | |
CIU | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A | 1VJ5 | 0.78 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.77 | |
BSU | 1,3-DIPHENYLUREA | A | 3E85 | 0.87 | |
BSU | 1,3-DIPHENYLUREA | A | 2ZJF | 0.87 | |
4ND | N4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINE | H,I | 1NO9 | 0.73 | |
1AN | 2-FLUOROANILINE | A | 1LGW | 0.75 | |
PL0 | 1-phenylguanidine | A | 2O8W | 0.81 | |
ANL | ANILINE | A | 2OV4 | 0.71 | |
ANL | ANILINE | A | 1AEE | 0.71 | |
ANL | ANILINE | A | 1PPA | 0.71 | |
ANL | ANILINE | A | 1HJ9 | 0.71 | |
IAP | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A | 1S6R | 0.71 | |
IAP | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A,B | 1K6S | 0.71 | |
DKI | 5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}- N-(2,6-DIFLUOROPHENYL)-1H-1,2,4- TRIAZOLE-1-CARBOTHIOAMIDE | A | 2W4O | 0.71 | |
DKI | 5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}- N-(2,6-DIFLUOROPHENYL)-1H-1,2,4- TRIAZOLE-1-CARBOTHIOAMIDE | A | 3HMI | 0.71 | |
DKI | 5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}- N-(2,6-DIFLUOROPHENYL)-1H-1,2,4- TRIAZOLE-1-CARBOTHIOAMIDE | A | 2J51 | 0.71 | |
DKI | 5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}- N-(2,6-DIFLUOROPHENYL)-1H-1,2,4- TRIAZOLE-1-CARBOTHIOAMIDE | A | 2CHL | 0.71 | |
DKI | 5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}- N-(2,6-DIFLUOROPHENYL)-1H-1,2,4- TRIAZOLE-1-CARBOTHIOAMIDE | A | 2JFL | 0.71 | |
PH3 | N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINE | A,B | 1DM6 | 0.71 | |
ASR | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.7 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.77 | |
URS | N-PHENYLTHIOUREA | A,B | 1BUG | 0.9 | |
264 | (phenylamino)acetonitrile | A | 2RBN | 0.77 | |
PHJ | N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE | A,B | 1UR9 | 0.73 |