Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00646484
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 |
4BH | 4-CHLORO-6-(4-PIPERAZIN-1-YL-1H- PYRAZOL-5-YL)BENZENE-1,3-DIOL | A | 2CCS | 0.75 | |
P4A | 4-[4-(4-methoxyphenyl)-5-methyl- 1H-pyrazol-3-yl]benzene-1,3-diol | A,B | 2ZDX | 0.84 | |
2D7 | N-(4-ACETYLPHENYL)-5-(5-CHLORO- 2,4-DIHYDROXYPHENYL)-1H-PYRAZOLE- 4-CARBOXAMIDE | A | 2BYH | 0.71 | |
PZL | 3-[6-bromo-2-fluoro-3-(1H-pyrazolo[3,4- c]pyridazin-3-ylmethyl)phenoxy]- 5-chlorobenzonitrile | A | 3DYA | 0.7 | |
M22 | 3-chloro-5-[2-chloro-5-(1H-indazol- 3-ylmethoxy)phenoxy]benzonitrile | A | 3C6U | 0.75 | |
2D9 | 4-CHLORO-6-(4-{4-[4-(METHYLSULFONYL)BENZYL]PIPERAZIN- 1-YL}-1H-PYRAZOL-5-YL)BENZENE-1,3- DIOL | A | 2CCU | 0.72 | |
CT5 | 4-[4-(2,3-DIHYDRO-1,4-BENZODIOXIN- 6-YL)-3-METHYL-1H-PYRAZOL-5-YL]- 6-ETHYLBENZENE-1,3-DIOL | A | 2BRC | 0.82 | |
CT5 | 4-[4-(2,3-DIHYDRO-1,4-BENZODIOXIN- 6-YL)-3-METHYL-1H-PYRAZOL-5-YL]- 6-ETHYLBENZENE-1,3-DIOL | A,B | 2CDD | 0.82 | |
CT5 | 4-[4-(2,3-DIHYDRO-1,4-BENZODIOXIN- 6-YL)-3-METHYL-1H-PYRAZOL-5-YL]- 6-ETHYLBENZENE-1,3-DIOL | A,B | 2BT0 | 0.82 | |
4BC | 4-(1,3-BENZODIOXOL-5-YL)-5-(5-ETHYL- 2,4-DIHYDROXYPHENYL)-2H-PYRAZOLE- 3-CARBOXYLIC ACID | A | 1YC3 | 0.71 | |
4BC | 4-(1,3-BENZODIOXOL-5-YL)-5-(5-ETHYL- 2,4-DIHYDROXYPHENYL)-2H-PYRAZOLE- 3-CARBOXYLIC ACID | A | 1YC1 | 0.71 | |
KJ2 | 4-{4-[4-(3-AMINOPROPOXY)PHENYL]- 1H-PYRAZOL-5-YL}-6-CHLOROBENZENE- 1,3-DIOL | A,B | 2BRE | 0.94 | |
BSM | 5-(5-CHLORO-2,4-DIHYDROXYPHENYL)- N-ETHYL-4-(4-METHOXYPHENYL)-1H- PYRAZOLE-3-CARBOXAMIDE | A | 2BSM | 0.77 | |
2DD | 3-(5-CHLORO-2,4-DIHYDROXY-PHENYL)- 1H-PYRAZOLE-4-CARBOXYLIC ACID 4- SULFAMOYL-BENZYLAMIDE | A | 2BYI | 0.7 | |
KN2 | 4-(6-HYDROXY-1H-INDAZOL-3-YL)BENZENE- 1,3-DIOL | A,B | 2QA6 | 0.73 |