Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00264585
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 |
ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | H,I | 1C5N | 0.71 |  |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5R | 0.71 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5Q | 0.71 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1O5B | 0.71 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1C5X | 0.71 | |
| ESI | 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | B | 1C5W | 0.71 | |
SM3 | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 1PI4 | 0.8 | |
| SM3 | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 2FFY | 0.8 | |
| SM3 | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 1MY8 | 0.8 | |
4FP | 4-(4-FLUOROBENZYL)PIPERIDINE | A | 2OHN | 0.71 | |
VA1 | {5-[(DIFORMYLAMINO)METHYL]-1-BENZOTHIEN- 2-YL}BORONIC ACID | A,B | 2I72 | 0.73 | |
AL5 | THIOPHENE-2,5-DISULFONIC ACID 2- AMIDE-5-(4-METHYL-BENZYLAMIDE) | A | 1BN1 | 0.77 | |
BTM | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.71 | |
ESX | BENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5S | 0.73 | |
ETS | (4S-TRANS)-4-(ETHYLAMINO)-5,6-DIHYDRO- 6-METHYL-4H-THIENO(2,3-B)THIOPYRAN- 2-SULFONAMIDE-7,7-DIOXIDE | A | 1CIL | 0.72 | |
271 | N-methyl-1-phenylmethanamine | X | 2RBT | 0.73 | |
SM4 | (1R)-1-(2-THIOPHEN-2-YL-ACETYLAMINO)- 1-(3-(2-CARBOXYVINYL)-PHENYL) METHYLBORONIC ACID | A,B | 2RCX | 0.72 | |
RM1 | N-METHYL-1(R)-AMINOINDAN | A,B | 2C67 | 0.71 | |
MTS | (4S-TRANS)-4-(METHYLAMINO)-5,6- DIHYDRO-6-METHYL-4H-THIENO(2,3- B)THIOPYRAN-2-SULFONAMIDE-7,7-DIOXIDE | A | 1CIN | 0.7 | |