Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02094297
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 |
NHP | 4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACID | A,B | 1CX9 | 0.7 | |
5BM | (2Z)-bis{amino[(2-aminophenyl)sulfanyl]methylidene}butanedinitrile | A | 3EQH | 0.71 | |
1MR | N-METHYLANILINE | X | 2OTZ | 0.75 | |
OSP | SULTHIAME | A | 2Q1Q | 0.72 | |
MPX | 4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDE | A | 1ZH9 | 0.74 | |
BSU | 1,3-DIPHENYLUREA | A | 3E85 | 0.76 | |
BSU | 1,3-DIPHENYLUREA | A | 2ZJF | 0.76 | |
SUA | (4-SULFAMOYL-PHENYL)-THIOCARBAMIC ACID O- (2-THIOPHEN-3-YL-ETHYL) ESTER | A | 1LUG | 0.71 | |
AMS | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.7 | |
URS | N-PHENYLTHIOUREA | A,B | 1BUG | 0.85 | |
NYL | N-ALLYL-ANILINE | A | 1OVK | 0.73 | |
PTU | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1K2T | 0.74 | |
PTU | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1D1V | 0.74 | |
SAN | SULFANILAMIDE | A | 1AJ0 | 0.71 | |
264 | (phenylamino)acetonitrile | A | 2RBN | 0.73 | |
ROK | 4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDE | A,B,C,D,E,F, G,H | 2VT5 | 0.72 | |
259 | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.71 | |
PL0 | 1-phenylguanidine | A | 2O8W | 0.77 | |
171 | 2-PHENYLAMINO-ETHANESULFONIC ACID | A,B | 1SXG | 0.7 | |
NR2 | N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)- 4-METHYLBENZENESULFONAMIDE | A | 1ZFK | 0.74 |