Assay Detail
Binding
CHEMBL1026934
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of Chk1
119
Total Activities
119
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Intermediate |
Target
Serine/threonine-protein kinase Chk1 (CHEMBL4630) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Large-scale application of high-throughput molecular mechanics with Poisson-Boltzmann surface area for routine physics-based scoring of protein-ligand complexes.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 119 | 7.21 | 10.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL248194 | — | — | 1 | 10.00 |
| CHEMBL245802 | — | — | 1 | 9.60 |
| CHEMBL249363 | — | — | 1 | 9.50 |
| CHEMBL550479 | — | — | 1 | 9.30 |
| CHEMBL538671 | — | — | 1 | 9.20 |
| CHEMBL537964 | — | — | 1 | 8.90 |
| CHEMBL558077 | — | — | 1 | 8.80 |
| CHEMBL542007 | — | — | 1 | 8.80 |
| CHEMBL245796 | — | — | 1 | 8.80 |
| CHEMBL551086 | — | — | 1 | 8.70 |
| CHEMBL541515 | — | — | 1 | 8.70 |
| CHEMBL559425 | — | — | 1 | 8.60 |
| CHEMBL540756 | — | — | 1 | 8.60 |
| CHEMBL559621 | — | — | 1 | 8.60 |
| CHEMBL195373 | — | — | 1 | 8.50 |
| CHEMBL550209 | — | — | 1 | 8.50 |
| CHEMBL207596 | — | — | 1 | 8.40 |
| CHEMBL560210 | — | — | 1 | 8.40 |
| CHEMBL232804 | — | — | 1 | 8.40 |
| CHEMBL549527 | — | — | 1 | 8.40 |
| CHEMBL563792 | — | — | 1 | 8.30 |
| CHEMBL550820 | — | — | 1 | 8.30 |
| CHEMBL555940 | — | — | 1 | 8.30 |
| CHEMBL248396 | — | — | 1 | 8.30 |
| CHEMBL550417 | — | — | 1 | 8.30 |
| CHEMBL540992 | — | — | 1 | 8.20 |
| CHEMBL549660 | — | — | 1 | 8.20 |
| CHEMBL438485 | — | — | 1 | 8.20 |
| CHEMBL562875 | — | — | 1 | 8.20 |
| CHEMBL559498 | — | — | 1 | 8.20 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL248194 | — | Ki | = | 0.1 | nM | 10.00 |
| CHEMBL245802 | — | Ki | = | 0.2512 | nM | 9.60 |
| CHEMBL249363 | — | Ki | = | 0.3162 | nM | 9.50 |
| CHEMBL550479 | — | Ki | = | 0.5012 | nM | 9.30 |
| CHEMBL538671 | — | Ki | = | 0.631 | nM | 9.20 |
| CHEMBL537964 | — | Ki | = | 1.259 | nM | 8.90 |
| CHEMBL245796 | — | Ki | = | 1.585 | nM | 8.80 |
| CHEMBL558077 | — | Ki | = | 1.585 | nM | 8.80 |
| CHEMBL542007 | — | Ki | = | 1.585 | nM | 8.80 |
| CHEMBL551086 | — | Ki | = | 1.995 | nM | 8.70 |
| CHEMBL541515 | — | Ki | = | 1.995 | nM | 8.70 |
| CHEMBL559425 | — | Ki | = | 2.512 | nM | 8.60 |
| CHEMBL559621 | — | Ki | = | 2.512 | nM | 8.60 |
| CHEMBL540756 | — | Ki | = | 2.512 | nM | 8.60 |
| CHEMBL195373 | — | Ki | = | 3.162 | nM | 8.50 |
| CHEMBL550209 | — | Ki | = | 3.162 | nM | 8.50 |
| CHEMBL549527 | — | Ki | = | 3.981 | nM | 8.40 |
| CHEMBL232804 | — | Ki | = | 3.981 | nM | 8.40 |
| CHEMBL560210 | — | Ki | = | 3.981 | nM | 8.40 |
| CHEMBL207596 | — | Ki | = | 3.981 | nM | 8.40 |
| CHEMBL550417 | — | Ki | = | 5.012 | nM | 8.30 |
| CHEMBL563792 | — | Ki | = | 5.012 | nM | 8.30 |
| CHEMBL248396 | — | Ki | = | 5.012 | nM | 8.30 |
| CHEMBL555940 | — | Ki | = | 5.012 | nM | 8.30 |
| CHEMBL550820 | — | Ki | = | 5.012 | nM | 8.30 |
| CHEMBL391449 | — | Ki | = | 6.31 | nM | 8.20 |
| CHEMBL562875 | — | Ki | = | 6.31 | nM | 8.20 |
| CHEMBL540992 | — | Ki | = | 6.31 | nM | 8.20 |
| CHEMBL559498 | — | Ki | = | 6.31 | nM | 8.20 |
| CHEMBL438485 | — | Ki | = | 6.31 | nM | 8.20 |
| CHEMBL549660 | — | Ki | = | 6.31 | nM | 8.20 |
| CHEMBL364347 | — | Ki | = | 7.943 | nM | 8.10 |
| CHEMBL389780 | — | Ki | = | 7.943 | nM | 8.10 |
| CHEMBL232392 | — | Ki | = | 7.943 | nM | 8.10 |
| CHEMBL391450 | — | Ki | = | 7.943 | nM | 8.10 |
| CHEMBL223512 | — | Ki | = | 7.943 | nM | 8.10 |
| CHEMBL549313 | — | Ki | = | 7.943 | nM | 8.10 |
| CHEMBL564952 | — | Ki | = | 10.0 | nM | 8.00 |
| CHEMBL207994 | — | Ki | = | 10.0 | nM | 8.00 |
| CHEMBL564542 | — | Ki | = | 10.0 | nM | 8.00 |
| CHEMBL389816 | — | Ki | = | 10.0 | nM | 8.00 |
| CHEMBL549661 | — | Ki | = | 10.0 | nM | 8.00 |
| CHEMBL563331 | — | Ki | = | 10.0 | nM | 8.00 |
| CHEMBL220035 | — | Ki | = | 12.59 | nM | 7.90 |
| CHEMBL540484 | — | Ki | = | 12.59 | nM | 7.90 |
| CHEMBL540993 | — | Ki | = | 12.59 | nM | 7.90 |
| CHEMBL549459 | — | Ki | = | 12.59 | nM | 7.90 |
| CHEMBL245605 | — | Ki | = | 12.59 | nM | 7.90 |
| CHEMBL550616 | — | Ki | = | 15.85 | nM | 7.80 |
| CHEMBL558271 | — | Ki | = | 15.85 | nM | 7.80 |