Assay Detail
Binding
CHEMBL4388634
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Inhibition of Mycobacterium tuberculosis His-tagged PtpB expressed in Escherichia coli Rosetta 2 (DE3) using pNPP as substrate after 30 mins by spectrophotometric method
146
Total Activities
146
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Mycobacterium tuberculosis |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Phosphotyrosine protein phosphatase (CHEMBL4295521) ↗| Type | SINGLE PROTEIN |
| Organism | Mycobacterium tuberculosis |
Publication
Dual-targeting GroEL/ES chaperonin and protein tyrosine phosphatase B (PtpB) inhibitors: A polypharmacology strategy for treating Mycobacterium tuberculosis infections.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 146 | 4.82 | 6.10 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3942054 | — | — | 1 | 6.10 |
| CHEMBL3938421 | — | — | 1 | 5.82 |
| CHEMBL4161487 | — | — | 1 | 5.70 |
| CHEMBL3934460 | — | — | 1 | 5.68 |
| CHEMBL4453551 | — | — | 1 | 5.66 |
| CHEMBL3904891 | — | — | 1 | 5.64 |
| CHEMBL3910488 | — | — | 1 | 5.64 |
| CHEMBL4162794 | — | — | 1 | 5.64 |
| CHEMBL4542408 | — | — | 1 | 5.64 |
| CHEMBL4590591 | — | — | 1 | 5.57 |
| CHEMBL3908434 | — | — | 1 | 5.55 |
| CHEMBL3970551 | — | — | 1 | 5.54 |
| CHEMBL4160098 | — | — | 1 | 5.52 |
| CHEMBL4166077 | — | — | 1 | 5.48 |
| CHEMBL4447455 | — | — | 1 | 5.47 |
| CHEMBL4446055 | — | — | 1 | 5.47 |
| CHEMBL3979736 | — | — | 1 | 5.44 |
| CHEMBL4545651 | — | — | 1 | 5.44 |
| CHEMBL4169499 | — | — | 1 | 5.42 |
| CHEMBL4518473 | — | — | 1 | 5.41 |
| CHEMBL4533148 | — | — | 1 | 5.41 |
| CHEMBL4167333 | — | — | 1 | 5.40 |
| CHEMBL4548710 | — | — | 1 | 5.39 |
| CHEMBL4449994 | — | — | 1 | 5.39 |
| CHEMBL3924343 | — | — | 1 | 5.38 |
| CHEMBL3975683 | — | — | 1 | 5.37 |
| CHEMBL4171392 | — | — | 1 | 5.36 |
| CHEMBL4168415 | — | — | 1 | 5.36 |
| CHEMBL4161583 | — | — | 1 | 5.34 |
| CHEMBL3950773 | — | — | 1 | 5.31 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3942054 | — | IC50 | = | 790.0 | nM | 6.10 |
| CHEMBL3938421 | — | IC50 | = | 1500.0 | nM | 5.82 |
| CHEMBL4161487 | — | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL3934460 | — | IC50 | = | 2100.0 | nM | 5.68 |
| CHEMBL4453551 | — | IC50 | = | 2200.0 | nM | 5.66 |
| CHEMBL3904891 | — | IC50 | = | 2300.0 | nM | 5.64 |
| CHEMBL4542408 | — | IC50 | = | 2300.0 | nM | 5.64 |
| CHEMBL4162794 | — | IC50 | = | 2300.0 | nM | 5.64 |
| CHEMBL3910488 | — | IC50 | = | 2300.0 | nM | 5.64 |
| CHEMBL4590591 | — | IC50 | = | 2700.0 | nM | 5.57 |
| CHEMBL3908434 | — | IC50 | = | 2800.0 | nM | 5.55 |
| CHEMBL3970551 | — | IC50 | = | 2900.0 | nM | 5.54 |
| CHEMBL4160098 | — | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL4166077 | — | IC50 | = | 3300.0 | nM | 5.48 |
| CHEMBL4447455 | — | IC50 | = | 3400.0 | nM | 5.47 |
| CHEMBL4446055 | — | IC50 | = | 3400.0 | nM | 5.47 |
| CHEMBL3979736 | — | IC50 | = | 3600.0 | nM | 5.44 |
| CHEMBL4545651 | — | IC50 | = | 3600.0 | nM | 5.44 |
| CHEMBL4169499 | — | IC50 | = | 3800.0 | nM | 5.42 |
| CHEMBL4518473 | — | IC50 | = | 3900.0 | nM | 5.41 |
| CHEMBL4533148 | — | IC50 | = | 3900.0 | nM | 5.41 |
| CHEMBL4167333 | — | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL4548710 | — | IC50 | = | 4100.0 | nM | 5.39 |
| CHEMBL4449994 | — | IC50 | = | 4100.0 | nM | 5.39 |
| CHEMBL3924343 | — | IC50 | = | 4200.0 | nM | 5.38 |
| CHEMBL3975683 | — | IC50 | = | 4300.0 | nM | 5.37 |
| CHEMBL4168415 | — | IC50 | = | 4400.0 | nM | 5.36 |
| CHEMBL4171392 | — | IC50 | = | 4400.0 | nM | 5.36 |
| CHEMBL4161583 | — | IC50 | = | 4600.0 | nM | 5.34 |
| CHEMBL3950773 | — | IC50 | = | 4900.0 | nM | 5.31 |
| CHEMBL4562570 | — | IC50 | = | 5000.0 | nM | 5.30 |
| CHEMBL4463085 | — | IC50 | = | 5100.0 | nM | 5.29 |
| CHEMBL4513892 | — | IC50 | = | 5300.0 | nM | 5.28 |
| CHEMBL4531689 | — | IC50 | = | 5400.0 | nM | 5.27 |
| CHEMBL4467368 | — | IC50 | = | 5500.0 | nM | 5.26 |
| CHEMBL3933283 | — | IC50 | = | 5800.0 | nM | 5.24 |
| CHEMBL4531228 | — | IC50 | = | 5700.0 | nM | 5.24 |
| CHEMBL3890411 | — | IC50 | = | 5800.0 | nM | 5.24 |
| CHEMBL4168023 | — | IC50 | = | 5900.0 | nM | 5.23 |
| CHEMBL3955935 | — | IC50 | = | 6200.0 | nM | 5.21 |
| CHEMBL4526007 | — | IC50 | = | 6400.0 | nM | 5.19 |
| CHEMBL3983712 | — | IC50 | = | 6400.0 | nM | 5.19 |
| CHEMBL4449196 | — | IC50 | = | 6500.0 | nM | 5.19 |
| CHEMBL3980253 | — | IC50 | = | 6400.0 | nM | 5.19 |
| CHEMBL4547546 | — | IC50 | = | 6800.0 | nM | 5.17 |
| CHEMBL4521813 | — | IC50 | = | 6700.0 | nM | 5.17 |
| CHEMBL3912547 | — | IC50 | = | 7000.0 | nM | 5.16 |
| CHEMBL1389174 | — | IC50 | = | 6900.0 | nM | 5.16 |
| CHEMBL4176697 | — | IC50 | = | 7100.0 | nM | 5.15 |
| CHEMBL4565697 | — | IC50 | = | 7100.0 | nM | 5.15 |