Assay Detail
Binding
CHEMBL4688201
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of N-terminal His tagged human Pin1 expressed in Escherichia coli BL21 (DE3) using Suc-Ala-Glu-Pro-Phe-4-nitroanilide as substrate preincubated with enzyme for 10 mins followed by substrate addition by UV-Vis spectrophotometer analysis
51
Total Activities
50
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (CHEMBL2288) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Design, synthesis and biological evaluation of novel thiazole-based derivatives as human Pin1 inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 50 | 5.05 | 7.05 |
| Ki | 1 | 8.22 | 8.22 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1090715 | — | — | 2 | 8.22 |
| CHEMBL4747066 | — | — | 1 | 6.02 |
| CHEMBL4781899 | — | — | 1 | 5.52 |
| CHEMBL4742724 | — | — | 1 | 5.44 |
| CHEMBL4783622 | — | — | 1 | 5.43 |
| CHEMBL4745501 | — | — | 1 | 5.42 |
| CHEMBL4753072 | — | — | 1 | 5.33 |
| CHEMBL4759454 | — | — | 1 | 5.30 |
| CHEMBL4765142 | — | — | 1 | 5.29 |
| CHEMBL4790783 | — | — | 1 | 5.28 |
| CHEMBL4757682 | — | — | 1 | 5.28 |
| CHEMBL4743739 | — | — | 1 | 5.27 |
| CHEMBL4760814 | — | — | 1 | 5.18 |
| CHEMBL4761110 | — | — | 1 | 5.17 |
| CHEMBL4777300 | — | — | 1 | 5.15 |
| CHEMBL4797407 | — | — | 1 | 5.13 |
| CHEMBL4753616 | — | — | 1 | 5.12 |
| CHEMBL4749012 | — | — | 1 | 5.08 |
| CHEMBL4753356 | — | — | 1 | 5.07 |
| CHEMBL4765114 | — | — | 1 | 5.07 |
| CHEMBL4750328 | — | — | 1 | 5.06 |
| CHEMBL4787691 | — | — | 1 | 5.04 |
| CHEMBL4759384 | — | — | 1 | 5.03 |
| CHEMBL4789882 | — | — | 1 | 5.00 |
| CHEMBL4741812 | — | — | 1 | 4.97 |
| CHEMBL4785937 | — | — | 1 | 4.94 |
| CHEMBL4796898 | — | — | 1 | 4.93 |
| CHEMBL4760537 | — | — | 1 | 4.89 |
| CHEMBL4765218 | — | — | 1 | 4.89 |
| CHEMBL4794469 | — | — | 1 | 4.88 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1090715 | — | Ki | = | 6.0 | nM | 8.22 |
| CHEMBL1090715 | — | IC50 | = | 90.0 | nM | 7.05 |
| CHEMBL4747066 | — | IC50 | = | 950.0 | nM | 6.02 |
| CHEMBL4781899 | — | IC50 | = | 3040.0 | nM | 5.52 |
| CHEMBL4742724 | — | IC50 | = | 3630.0 | nM | 5.44 |
| CHEMBL4783622 | — | IC50 | = | 3750.0 | nM | 5.43 |
| CHEMBL4745501 | — | IC50 | = | 3770.0 | nM | 5.42 |
| CHEMBL4753072 | — | IC50 | = | 4710.0 | nM | 5.33 |
| CHEMBL4759454 | — | IC50 | = | 5040.0 | nM | 5.30 |
| CHEMBL4765142 | — | IC50 | = | 5070.0 | nM | 5.29 |
| CHEMBL4757682 | — | IC50 | = | 5260.0 | nM | 5.28 |
| CHEMBL4790783 | — | IC50 | = | 5300.0 | nM | 5.28 |
| CHEMBL4743739 | — | IC50 | = | 5340.0 | nM | 5.27 |
| CHEMBL4760814 | — | IC50 | = | 6550.0 | nM | 5.18 |
| CHEMBL4761110 | — | IC50 | = | 6780.0 | nM | 5.17 |
| CHEMBL4777300 | — | IC50 | = | 7150.0 | nM | 5.15 |
| CHEMBL4797407 | — | IC50 | = | 7430.0 | nM | 5.13 |
| CHEMBL4753616 | — | IC50 | = | 7640.0 | nM | 5.12 |
| CHEMBL4749012 | — | IC50 | = | 8300.0 | nM | 5.08 |
| CHEMBL4765114 | — | IC50 | = | 8500.0 | nM | 5.07 |
| CHEMBL4753356 | — | IC50 | = | 8460.0 | nM | 5.07 |
| CHEMBL4750328 | — | IC50 | = | 8740.0 | nM | 5.06 |
| CHEMBL4787691 | — | IC50 | = | 9090.0 | nM | 5.04 |
| CHEMBL4759384 | — | IC50 | = | 9320.0 | nM | 5.03 |
| CHEMBL4789882 | — | IC50 | = | 10110.0 | nM | 5.00 |
| CHEMBL4741812 | — | IC50 | = | 10790.0 | nM | 4.97 |
| CHEMBL4785937 | — | IC50 | = | 11380.0 | nM | 4.94 |
| CHEMBL4796898 | — | IC50 | = | 11690.0 | nM | 4.93 |
| CHEMBL4760537 | — | IC50 | = | 12780.0 | nM | 4.89 |
| CHEMBL4765218 | — | IC50 | = | 12910.0 | nM | 4.89 |
| CHEMBL4794469 | — | IC50 | = | 13350.0 | nM | 4.88 |
| CHEMBL4798629 | — | IC50 | = | 13700.0 | nM | 4.86 |
| CHEMBL4763158 | — | IC50 | = | 13980.0 | nM | 4.85 |
| CHEMBL4753746 | — | IC50 | = | 16120.0 | nM | 4.79 |
| CHEMBL4782914 | — | IC50 | = | 16420.0 | nM | 4.79 |
| CHEMBL4761306 | — | IC50 | = | 16610.0 | nM | 4.78 |
| CHEMBL4741624 | — | IC50 | = | 16830.0 | nM | 4.77 |
| CHEMBL4794826 | — | IC50 | = | 17710.0 | nM | 4.75 |
| CHEMBL4776635 | — | IC50 | = | 19730.0 | nM | 4.71 |
| CHEMBL4742117 | — | IC50 | = | 23180.0 | nM | 4.63 |
| CHEMBL4755778 | — | IC50 | = | 28000.0 | nM | 4.55 |
| CHEMBL4761982 | — | IC50 | = | 28520.0 | nM | 4.54 |
| CHEMBL4790425 | — | IC50 | = | 37070.0 | nM | 4.43 |
| CHEMBL4791740 | — | IC50 | = | 46890.0 | nM | 4.33 |
| CHEMBL4744021 | — | IC50 | = | 100000.0 | nM | 4.00 |
| CHEMBL4745691 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL4781481 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL4793454 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL4778416 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL4792086 | — | IC50 | > | 100000.0 | nM | - |