Compound Detail
CHEMBL1972221
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Basic Information
| ChEMBL ID | CHEMBL1972221 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OEKYVFZKBRIDJO-UHFFFAOYSA-N |
30
Targets
30
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
386.5
MW (Da)
3.73
ALogP
4
HBA
3
HBD
104.0
PSA (Ų)
0.58
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 30 meas. best 7.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 alpha CHEMBL2850 | Ki | 7.5 | 7.5 | 31.6 | 1 |
| Tyrosine-protein kinase JAK2 CHEMBL2971 | Ki | 7.4 | 7.4 | 39.8 | 1 |
| Cyclin-dependent kinase 2 CHEMBL301 | Ki | 7.2 | 7.2 | 63.1 | 1 |
| Glycogen synthase kinase-3 beta CHEMBL262 | Ki | 7.2 | 7.2 | 63.1 | 1 |
| Non-receptor tyrosine-protein kinase TYK2 CHEMBL3553 | Ki | 7.1 | 7.1 | 79.4 | 1 |
| Cyclin-dependent kinase 1 CHEMBL308 | Ki | 6.8 | 6.8 | 158.5 | 1 |
| Tyrosine-protein kinase JAK3 CHEMBL2148 | Ki | 6.6 | 6.6 | 251.2 | 1 |
| Dual specificity tyrosine-phosphorylation-regulated kinase 1A CHEMBL2292 | Ki | 6.5 | 6.5 | 316.2 | 1 |
| Death-associated protein kinase 3 CHEMBL2468 | Ki | 6.4 | 6.4 | 398.1 | 1 |
| Dual specificity protein kinase CLK4 CHEMBL4203 | Ki | 6.4 | 6.4 | 398.1 | 1 |
| Cyclin-dependent kinase 5 CHEMBL4036 | Ki | 6.4 | 6.4 | 398.1 | 1 |
| Serine/threonine-protein kinase 17A CHEMBL4525 | Ki | 6.1 | 6.1 | 794.3 | 1 |
| Mitogen-activated protein kinase 8 CHEMBL2276 | Ki | 5.9 | 5.9 | 1258.9 | 1 |
| Aurora kinase A CHEMBL4722 | Ki | 5.8 | 5.8 | 1584.9 | 1 |
| Dual specificity protein kinase CLK2 CHEMBL4225 | Ki | 5.7 | 5.7 | 1995.3 | 1 |
| Serine/threonine-protein kinase PLK4 CHEMBL3788 | Ki | 5.7 | 5.7 | 1995.3 | 1 |
| Mitogen-activated protein kinase 9 CHEMBL4179 | Ki | 5.7 | 5.7 | 1995.3 | 1 |
| Mitogen-activated protein kinase 1 CHEMBL4040 | Ki | 5.7 | 5.7 | 1995.3 | 1 |
| Casein kinase I isoform gamma-1 CHEMBL2426 | Ki | 5.6 | 5.6 | 2511.9 | 1 |
| Mitogen-activated protein kinase 12 CHEMBL4674 | Ki | 5.6 | 5.6 | 2511.9 | 1 |
| Homeodomain-interacting protein kinase 4 CHEMBL1075167 | Ki | 5.6 | 5.6 | 2511.9 | 1 |
| Dual specificity tyrosine-phosphorylation-regulated kinase 3 CHEMBL4575 | Ki | 5.3 | 5.3 | 5011.9 | 1 |
| Mitogen-activated protein kinase 13 CHEMBL2939 | Ki | 5.3 | 5.3 | 5011.9 | 1 |
| LIM domain kinase 1 CHEMBL3836 | Ki | 5.2 | 5.2 | 6309.6 | 1 |
| Aurora kinase B CHEMBL2185 | Ki | 5.2 | 5.2 | 6309.6 | 1 |
| Ribosomal protein S6 kinase beta-1 CHEMBL4501 | Ki | 5.2 | 5.2 | 6309.6 | 1 |
| Serine/threonine-protein kinase N2 CHEMBL3032 | Ki | 5.2 | 5.2 | 6309.6 | 1 |
| Protein kinase C gamma type CHEMBL2938 | Ki | 5.1 | 5.1 | 7943.3 | 1 |
| Serine/threonine-protein kinase TAO1 CHEMBL5261 | Ki | 5.1 | 5.1 | 7943.3 | 1 |
| Serine/threonine-protein kinase Sgk2 CHEMBL5794 | Ki | 5.1 | 5.1 | 7943.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine