Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02580504
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 |
R23![]() | METHYL-[4-(4-PIPERIDINE-1-YLMETHYL- PHENYL)-CYCLOHEXYL]-CARBAMINIC ACID- (4-CHLOROPHENYL)-ESTER | A,B,C | 1O79 | 0.72 | ![]() |
PET![]() | 1,5-DI(4-AMIDINOPHENOXY)-3-OXA- PENTANE | B | 166D | 0.7 | ![]() |
SNB![]() | 1-(3-BROMOPHENYL)-7-CHLORO-6-METHOXY- 3,4-DIHYDROISOQUINOLINE | A | 2WAJ | 0.77 | ![]() |
DID![]() | 4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDE | A,B,C,D | 1RPW | 0.71 | ![]() |
ROS![]() | N,N'-TETRAMETHYL-ROSAMINE | A | 1F1T | 0.73 | ![]() |
PNT![]() | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | X | 3CR4 | 0.7 | ![]() |
PNT![]() | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | B | 1D64 | 0.7 | ![]() |
PNT![]() | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | X | 3CR5 | 0.7 | ![]() |
PNT![]() | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | A,B,D,E | 1RKW | 0.7 | ![]() |
TNT![]() | 1,3-BIS(AMIDINOPHENOXY)PROPANE | B | 102D | 0.71 | ![]() |
TNT![]() | 1,3-BIS(AMIDINOPHENOXY)PROPANE | A | 1PRP | 0.71 | ![]() |
TAX![]() | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINIUM | A | 1FJ5 | 0.7 | ![]() |
C18![]() | 7-[(3-CHLOROBENZYL)OXY]-4-[(METHYLAMINO)METHYL]- 2H-CHROMEN-2-ONE | A,B | 2V61 | 0.73 | ![]() |
QUM![]() | QUINACRINE MUSTARD | A,B | 1GXF | 0.7 | ![]() |
CTX![]() | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINE | A,B,C | 1YA4 | 0.73 | ![]() |