Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03695829
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 |
RXC | (1S)-1-(3-chlorophenyl)-2-oxo-2- [(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin- 5-yl)amino]ethyl acetate | A,B,C,D | 3DEJ | 0.73 | |
IN0 | N-{2-[TRANS-7-CHLORO-1-(2,2-DIMETHYL- PROPYL) -5-NAPHTHALEN-1-YL-2-OXO- 1,2,3,5-TETRAHYDRO-BENZO[E] [1,4]OXAZEPIN- 3-YL]-ACETYL}-ASPARTIC ACID | A,B,C | 1EZF | 0.7 | |
QUM | QUINACRINE MUSTARD | A,B | 1GXF | 0.71 | |
UC3 | 1-METHYL ETHYL 2-CHLORO-5-[[[(1- METHYLETHOXY)THIOOXO]METHYL]AMINO]- BENZOATE | A | 1RT6 | 0.72 | |
H20 | 6-CHLORO-4-(CYCLOHEXYLOXY)-3-ISOPROPYLQUINOLIN- 2(1H)-ONE | A | 1TL3 | 0.8 | |
EFZ | (-)-6-CHLORO-4-CYCLOPROPYLETHYNYL- 4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H- 3,1-BENZOXAZIN-2-ONE | A | 1FKO | 0.89 | |
EFZ | (-)-6-CHLORO-4-CYCLOPROPYLETHYNYL- 4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H- 3,1-BENZOXAZIN-2-ONE | A | 1IKW | 0.89 | |
EFZ | (-)-6-CHLORO-4-CYCLOPROPYLETHYNYL- 4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H- 3,1-BENZOXAZIN-2-ONE | A | 1JKH | 0.89 | |
EFZ | (-)-6-CHLORO-4-CYCLOPROPYLETHYNYL- 4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H- 3,1-BENZOXAZIN-2-ONE | A | 1FK9 | 0.89 | |
EFZ | (-)-6-CHLORO-4-CYCLOPROPYLETHYNYL- 4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H- 3,1-BENZOXAZIN-2-ONE | A | 1IKV | 0.89 | |
H12 | 6-CHLORO-4-(CYCLOHEXYLOXY)-3-PROPYLQUINOLIN- 2(1H)-ONE | A | 1TKT | 0.8 |