Assay Detail
Binding
CHEMBL4375393
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Inhibition of integrin alphavbeta3 (unknown origin) expressed in human K562 cells assessed as reduction in cell adhesion to GST-LAP1 (242 to 252 amino acids) incubated for 30 mins by fluorescent probe BCECF-AM based fluorescence assay
10
Total Activities
10
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Cell Type | K562 |
| Confidence | 7 — Homologous single protein target |
| Curated By | Autocuration |
Publication
Profile of a Highly Selective Quaternized Pyrrolidine Betaine α<sub>v</sub>β<sub>6</sub> Integrin Inhibitor-(3<i>S</i>)-3-(3-(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl)phenyl)-4-((1<i>S</i> and 1<i>R</i>,3<i>R</i>)-1-methyl-3-(2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl)pyrrolidin-1-ium-1-yl)butanoate Synthesized by Stereoselective Methylation.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 9 | 5.79 | 6.60 |
| pIC50 | 1 | - | - |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4239085 | — | — | 1 | 6.60 |
| CHEMBL4446267 | — | — | 1 | 6.40 |
| CHEMBL4238909 | — | — | 1 | 6.20 |
| CHEMBL4246089 | GSK-3008348 | 1.0 | 1 | 6.00 |
| CHEMBL4589933 | — | — | 1 | 5.40 |
| CHEMBL4446786 | — | — | 1 | 5.30 |
| CHEMBL4468357 | — | — | 1 | 5.20 |
| CHEMBL4593110 | — | — | 1 | 5.20 |
| CHEMBL4573716 | — | — | 1 | - |
| CHEMBL4516070 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4239085 | — | IC50 | = | 251.19 | nM | 6.60 |
| CHEMBL4446267 | — | IC50 | = | 398.11 | nM | 6.40 |
| CHEMBL4238909 | — | IC50 | = | 630.96 | nM | 6.20 |
| CHEMBL4246089 | GSK-3008348 | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL4589933 | — | IC50 | = | 3981.07 | nM | 5.40 |
| CHEMBL4446786 | — | IC50 | = | 5011.87 | nM | 5.30 |
| CHEMBL4468357 | — | IC50 | = | 6309.57 | nM | 5.20 |
| CHEMBL4593110 | — | IC50 | = | 6309.57 | nM | 5.20 |
| CHEMBL4573716 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL4516070 | — | pIC50 | - | — | - |