Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00626659
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 |
501 | N7-BUTYL-N2-(5-CHLORO-2-METHYLPHENYL)- 5-METHYL[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE- 2,7-DIAMINE | A,B | 1ZGV | 0.74 | |
468 | (3S)-N-(3-CHLORO-2-METHYLPHENYL)- 1-CYCLOHEXYL-5-OXOPYRROLIDINE-3- CARBOXAMIDE | A | 2H7P | 0.7 | |
BSU | 1,3-DIPHENYLUREA | A | 3E85 | 0.71 | |
BSU | 1,3-DIPHENYLUREA | A | 2ZJF | 0.71 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.7 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.7 | |
ZAT | 4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE) | A | 2W0J | 0.7 | |
1JZ | 1-[4-(hydroxymethyl)phenyl]guanidine | B | 3FVF | 0.7 | |
2CM | 2-CHLORO-6-METHYL-ANILINE | A | 1OVH | 0.75 | |
IET | 1-(4-CYANO-PHENYL)-3-[2-(2,6-DICHLORO- PHENYL)-1-IMINO-ETHYL]-THIOUREA | A | 1S6P | 0.8 | |
RJ1 | N-[2-chloro-5-(trifluoromethyl)phenyl]imidodicarbonimidic diamide | A,B,C,D | 3DGA | 0.89 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.71 | |
CXX | 3-(3-CHLORO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q6H | 0.73 | |
CXX | 3-(3-CHLORO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N,N-DIMETHYLPROPAN-1-AMINE | A | 2QEI | 0.73 | |
CLU | 2,6-DICHLORO-N-IMIDAZOLIDIN-2-YLIDENEANILINE | A,B,D,E | 2PNC | 0.71 | |
URS | N-PHENYLTHIOUREA | A,B | 1BUG | 0.71 | |
L10 | N-[(3Z)-5-TERT-BUTYL-2-PHENYL-1,2- DIHYDRO-3H-PYRAZOL-3-YLIDENE]-N'- (4-CHLOROPHENYL)UREA | A | 1W82 | 0.71 | |
PH3 | N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINE | A,B | 1DM6 | 0.83 | |
TBO | 5-CHLORO-8-METHYL-7-(3-METHYL-BUT- 2-ENYL)-6,7,8,9-TETRAHYDRO-2H-2,7,9A- TRIAZA-BENZO[CD]AZULENE-1-THIONE | A | 1HNV | 0.73 | |
TBO | 5-CHLORO-8-METHYL-7-(3-METHYL-BUT- 2-ENYL)-6,7,8,9-TETRAHYDRO-2H-2,7,9A- TRIAZA-BENZO[CD]AZULENE-1-THIONE | A | 1UWB | 0.73 | |
C1M | 1-(4-CHLOROPHENYL)-2,3-DIHYDRO- 1H-TETRAZOLE | B,I | 2C90 | 0.71 | |
4PG | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.71 | |
PL0 | 1-phenylguanidine | A | 2O8W | 0.78 | |
GP6 | 1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA | A | 1BJU | 0.83 | |
TB9 | 4-CHLORO-8-METHYL-7-(3-METHYL-BUT- 2-ENYL)-6,7,8,9-TETRAHYDRO-2H-2,7,9A- TRIAZA-BENZO[CD]AZULENE-1-THIONE | A | 1REV | 0.71 | |
TB9 | 4-CHLORO-8-METHYL-7-(3-METHYL-BUT- 2-ENYL)-6,7,8,9-TETRAHYDRO-2H-2,7,9A- TRIAZA-BENZO[CD]AZULENE-1-THIONE | A | 1TVR | 0.71 |