Compound Detail
CHEMBL1427185
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Basic Information
| ChEMBL ID | CHEMBL1427185 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XRJVXAMPYWOKBH-UHFFFAOYSA-N |
11
Targets
17
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
319.7
MW (Da)
2.09
ALogP
4
HBA
1
HBD
62.3
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 13 meas. best 6.42
EC50 4 meas. best 5.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.42 | 5.62 | 383.0 | 2 |
| Voltage-gated N-type calcium channel alpha-1B subunit/Amyloid beta A4 precursor protein-binding family A member 1 CHEMBL2097170 | IC50 | 5.82 | 5.37 | 1530.0 | 2 |
| CHO CHEMBL613853 | IC50 | 5.79 | 5.79 | 1625.0 | 1 |
| Tyrosine-protein kinase JAK2 CHEMBL2971 | IC50 | 5.75 | 5.75 | 1760.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.55 | 5.475 | 2783.0 | 2 |
| Toll-like receptor 9 CHEMBL5804 | IC50 | 5.15 | 5.15 | 7134.0 | 1 |
| Beta Lactamase CHEMBL1293246 | IC50 | 5.1 | 5.1 | 7938.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 4.98 | 4.98 | 10409.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 4.98 | 4.98 | 10380.0 | 1 |
| Melanocortin receptor 4 CHEMBL259 | IC50 | 4.91 | 4.91 | 12255.0 | 1 |
| C-C chemokine receptor type 6 CHEMBL4423 | IC50 | 4.8 | 4.8 | 15900.0 | 1 |
| Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase CHEMBL1741212 | IC50 | 4.7 | 4.4467 | 20000.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine