Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01045916
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 |
AXB | A | 3DPE | 0.84 | ||
AXB | A,B | 3DPF | 0.84 | ||
D16 | TOMUDEX | A,B | 1I00 | 0.72 | |
D16 | TOMUDEX | A,B | 2KCE | 0.72 | |
D16 | TOMUDEX | A,B,C,D | 2TSR | 0.72 | |
D16 | TOMUDEX | A,B,C,D | 1HVY | 0.72 | |
D16 | TOMUDEX | A,B | 1RTS | 0.72 | |
FRM | 2-{3-[4-(4-FLUOROPHENYL)-3,6-DIHYDRO- 1(2H)-PYRIDINYL]PROPYL}-8-METHYL- 4(3H)-QUINAZOLINONE | A,B | 1UK0 | 0.71 | |
1CE | 3-(1H-tetrazol-5-ylmethyl)-5,6,7,8- tetrahydro[1]benzothieno[2,3-d]pyrimidin- 4(3H)-one | A,B | 3G34 | 0.72 | |
C0M | N-{3-CYANO-6-[3-(1-PIPERIDINYL)PROPANOYL]- 4,5,6,7-TETRAHYDROTHIENO[2,3-C]PYRIDIN- 2-YL}1-NAPHTHALENECARBOXAMIDE | A | 2O0U | 0.72 | |
KMB | 2-AMINO-6-AMINOMETHYL-8-PHENYLSULFANYLMETHYL- 3H-QUINAZOLIN-4-ONE | A | 1Q66 | 0.7 | |
SY1 | 2-({2-[(3R)-3-AMINOPIPERIDIN-1- YL]-4-OXOQUINAZOLIN-3(4H)-YL}METHYL)BENZONITRILE | A,B,C,D | 2ONC | 0.7 | |
38M | 3-(3-chlorophenyl)-2-({(1S)-1-[(6S)- 2,8-diazaspiro[5.5]undec-2-ylcarbonyl]pentyl}sulfanyl)quinazolin- 4(3H)-one | A | 3F9N | 0.7 |