Assay Detail
Binding
CHEMBL4006785
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Inhibition of N-terminal His-tagged human recombinant FPPS expressed in Escherichia coli BL21 (DE3) using GPP and [3H]-IPP as substrate preincubated for 10 mins before substrate addition measured after 8 mins by liquid scintillation counting
28
Total Activities
28
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Pharmacophore Mapping of Thienopyrimidine-Based Monophosphonate (ThP-MP) Inhibitors of the Human Farnesyl Pyrophosphate Synthase.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 28 | 5.61 | 6.07 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4062596 | — | — | 1 | 6.07 |
| CHEMBL1231307 | — | — | 1 | 6.07 |
| CHEMBL4072263 | — | — | 1 | 6.06 |
| CHEMBL4100337 | — | — | 1 | 6.00 |
| CHEMBL4085285 | — | — | 1 | 6.00 |
| CHEMBL4090564 | — | — | 1 | 5.96 |
| CHEMBL4074061 | — | — | 1 | 5.85 |
| CHEMBL4063665 | — | — | 1 | 5.82 |
| CHEMBL4095113 | — | — | 1 | 5.80 |
| CHEMBL3299149 | — | — | 1 | 5.80 |
| CHEMBL4100741 | — | — | 1 | 5.80 |
| CHEMBL4087424 | — | — | 1 | 5.64 |
| CHEMBL4079542 | — | — | 1 | 5.58 |
| CHEMBL4082744 | — | — | 1 | 5.55 |
| CHEMBL4073585 | — | — | 1 | 5.52 |
| CHEMBL3299051 | — | — | 1 | 5.48 |
| CHEMBL4094213 | — | — | 1 | 5.43 |
| CHEMBL4090167 | — | — | 1 | 5.40 |
| CHEMBL4068738 | — | — | 1 | 5.34 |
| CHEMBL4093024 | — | — | 1 | 5.34 |
| CHEMBL4068147 | — | — | 1 | 5.32 |
| CHEMBL3299047 | — | — | 1 | 5.30 |
| CHEMBL4089846 | — | — | 1 | 5.08 |
| CHEMBL4067698 | — | — | 1 | 5.06 |
| CHEMBL4097575 | — | — | 1 | 5.00 |
| CHEMBL4093973 | — | — | 1 | - |
| CHEMBL4062145 | — | — | 1 | - |
| CHEMBL4079020 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4062596 | — | IC50 | = | 860.0 | nM | 6.07 |
| CHEMBL1231307 | — | IC50 | = | 850.0 | nM | 6.07 |
| CHEMBL4072263 | — | IC50 | = | 870.0 | nM | 6.06 |
| CHEMBL4100337 | — | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL4085285 | — | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL4090564 | — | IC50 | = | 1100.0 | nM | 5.96 |
| CHEMBL4074061 | — | IC50 | = | 1400.0 | nM | 5.85 |
| CHEMBL4063665 | — | IC50 | = | 1500.0 | nM | 5.82 |
| CHEMBL4095113 | — | IC50 | = | 1600.0 | nM | 5.80 |
| CHEMBL3299149 | — | IC50 | = | 1600.0 | nM | 5.80 |
| CHEMBL4100741 | — | IC50 | = | 1600.0 | nM | 5.80 |
| CHEMBL4087424 | — | IC50 | = | 2300.0 | nM | 5.64 |
| CHEMBL4079542 | — | IC50 | = | 2600.0 | nM | 5.58 |
| CHEMBL4082744 | — | IC50 | = | 2800.0 | nM | 5.55 |
| CHEMBL4073585 | — | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL3299051 | — | IC50 | = | 3300.0 | nM | 5.48 |
| CHEMBL4094213 | — | IC50 | = | 3700.0 | nM | 5.43 |
| CHEMBL4090167 | — | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL4068738 | — | IC50 | = | 4600.0 | nM | 5.34 |
| CHEMBL4093024 | — | IC50 | = | 4600.0 | nM | 5.34 |
| CHEMBL4068147 | — | IC50 | = | 4800.0 | nM | 5.32 |
| CHEMBL3299047 | — | IC50 | = | 5000.0 | nM | 5.30 |
| CHEMBL4089846 | — | IC50 | = | 8400.0 | nM | 5.08 |
| CHEMBL4067698 | — | IC50 | = | 8800.0 | nM | 5.06 |
| CHEMBL4097575 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL4093973 | — | IC50 | >= | 100000.0 | nM | - |
| CHEMBL4062145 | — | IC50 | >= | 100000.0 | nM | - |
| CHEMBL4079020 | — | IC50 | > | 100000.0 | nM | - |