Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02552392
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 |
VA1 | {5-[(DIFORMYLAMINO)METHYL]-1-BENZOTHIEN- 2-YL}BORONIC ACID | A,B | 2I72 | 0.78 |  |
BZU | (4R)-2-(2-ethoxyethyl)-4-(ethylamino)- 3,4-dihydro-2H-thieno[3,2-e][1,2]thiazine- 6-sulfonamide 1,1-dioxide | A | 1A42 | 0.71 | |
BZB | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 3FKV | 0.7 | |
| BZB | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 1C3B | 0.7 | |
SM3 | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 1PI4 | 0.76 | |
| SM3 | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 2FFY | 0.76 | |
| SM3 | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 1MY8 | 0.76 | |
AL5 | THIOPHENE-2,5-DISULFONIC ACID 2- AMIDE-5-(4-METHYL-BENZYLAMIDE) | A | 1BN1 | 0.72 | |
AL4 | (R)-4-ETHYLAMINO-3,4-DIHYDRO-2- (2-METHOYLETHYL)-2H-THIENO[3,2- E]-1,2-THIAZINE-6-SULFONAMIDE-1,1- DIOXIDE | A | 1BNQ | 0.72 | |
ESX | BENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5S | 0.75 | |
ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | H,I | 1C5N | 0.73 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5R | 0.73 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5Q | 0.73 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1O5B | 0.73 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1C5X | 0.73 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1C5W | 0.73 | |