Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02341883
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 |
34Q![]() | (3R,4R)-4-(pyrrolidin-1-ylcarbonyl)- 1-(quinoxalin-2-ylcarbonyl)pyrrolidin- 3-amine | A | 2RIP | 0.8 | ![]() |
QYT![]() | (5E)-5-(QUINOXALIN-6-YLMETHYLENE)- 1,3-THIAZOLIDINE-2,4-DIONE | A | 2A5U | 0.71 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1PFE | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 2DA8 | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,C,E,G | 2ADW | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1VS2 | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1XVN | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 185D | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1XVK | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,C | 1XVR | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 3GO3 | 0.76 | ![]() |
8AD![]() | 9-AMINO-(N-(2-DIMETHYLAMINO)BUTYL)ACRIDINE- 4-CARBOXAMIDE | A,B | 1FN2 | 0.71 | ![]() |
8AD![]() | 9-AMINO-(N-(2-DIMETHYLAMINO)BUTYL)ACRIDINE- 4-CARBOXAMIDE | A,B | 1FN1 | 0.71 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 1MTB | 0.74 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 2FGV | 0.74 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | I | 1IVQ | 0.74 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 2FGU | 0.74 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A | 1JLD | 0.74 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 1HXB | 0.74 | ![]() |
9AD![]() | 9-AMINO-(N-(2-DIMETHYLAMINO)ETHYL)ACRIDINE- 4-CARBOXAMIDE | A | 465D | 0.72 | ![]() |
9AD![]() | 9-AMINO-(N-(2-DIMETHYLAMINO)ETHYL)ACRIDINE- 4-CARBOXAMIDE | A | 452D | 0.72 | ![]() |
9AC![]() | 9-ACRIDINECARBONYL | A,B,G,J,K,L,M | 1G3X | 0.71 | ![]() |
7AD![]() | 9-AMINO-N-[3-(DIMETHYLAMINO)PROPYL]ACRIDINE- 4-CARBOXAMIDE | A,B | 1RQY | 0.71 | ![]() |
CNQ![]() | 3-(4-CHLOROPHENYL)QUINOXALINE-5- CARBOXAMIDE | A,B,C,D | 1WOK | 0.74 | ![]() |
XR2![]() | 1-METHYL-9-[12-(9-METHYLPHENAZIN- 10-IUM-1-YL)-12-OXO-2,11-DIAZA- 5,8-DIAZONIADODEC-1-ANOYL]PHENAZIN- 10-IUM | A | 1X95 | 0.73 | ![]() |
THA![]() | TACRINE | A,B | 2AOW | 0.7 | ![]() |
THA![]() | TACRINE | A,B,C,D,E,F | 1MX1 | 0.7 | ![]() |
THA![]() | TACRINE | A,B | 2AOX | 0.7 | ![]() |
THA![]() | TACRINE | A | 1ACJ | 0.7 | ![]() |
FQX![]() | [1,2,5]oxadiazolo[3,4-g]quinoxaline- 6,7(5H,8H)-dione 1-oxide | B,C,D,P | 3BKI | 0.71 | ![]() |
BFA![]() | 9-BROMO-PHENAZINE-1-CARBOXYLIC ACID (2- DIMETHYLAMINO-ETHYL)-AMIDE | A,B | 1EG6 | 0.73 | ![]() |
LUM![]() | LUMICHROME | A | 2CC6 | 0.76 | ![]() |
LUM![]() | LUMICHROME | A,B | 1S4M | 0.76 | ![]() |
LUM![]() | LUMICHROME | A | 2CC7 | 0.76 | ![]() |
LUM![]() | LUMICHROME | A | 1HE5 | 0.76 | ![]() |