Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03025906
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 |
I06 | 2-PHENETHYL-2,3-DIHYDRO-PHTHALAZINE- 1,4-DIONE | D,E,F,G,H,L, M,N,O,P | 1EEF | 0.77 | |
PZQ | PRAZIQUANTEL | A | 1GTB | 0.72 | |
RXA | isoquinoline-1,3,4(2H)-trione | A,B,C,D | 3DEH | 0.88 | |
SP9 | N-{(1R)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNT | 0.71 | |
APZ | 4-AMINOPHTHALHYDRAZIDE | A | 1ENU | 0.7 | |
BHO | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.8 | |
BHO | BENZHYDROXAMIC ACID | A | 1HSR | 0.8 | |
BHO | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.8 | |
BHO | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.8 | |
BHO | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.8 | |
BHO | BENZHYDROXAMIC ACID | A | 3GCK | 0.8 | |
BHO | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.8 | |
KHA | 1-(4-{[(2-HYDROXYETHYL)AMINO]CARBONYL}BENZYL)- 1-METHYLPIPERIDINIUM | H,L,X,Y | 1UWG | 0.71 | |
BVA | TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE | B,C | 2P8O | 0.76 | |
ALR | ALRESTATIN | A | 1AZ1 | 0.78 | |
SP8 | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNS | 0.71 | |
DHQ | 3,4-DIHYDRO-5-METHYL-ISOQUINOLINONE | A | 1PAX | 0.82 | |
4PI | N-(4-METHYLBENZOYL)-4-BENZYLPIPERIDINE | A,B | 2NSD | 0.75 | |
4AN | 6-AMINO-BENZO[DE]ISOQUINOLINE-1,3- DIONE | A | 2PAX | 0.75 |