Compound Detail
CHEMBL408194
OBATOCLAX 🧪 Phase III
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🧪 Phase III
Basic Information
| ChEMBL ID | CHEMBL408194 |
| Name | OBATOCLAX |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | RFTSSZJZXOSICM-GRSHGNNSSA-N |
10
Targets
23
Activities
3
Assay Types
1
PK Parameters
20
Publications
2
Known Names
2
Indications
Molecular Properties
317.4
MW (Da)
4.49
ALogP
2
HBA
2
HBD
53.2
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Indications
Leukemia, Myeloid, Acute Small Cell Lung Carcinoma
Activity Summary
Ki 10 meas. best 6.0
IC50 9 meas. best 5.96
EC50 4 meas. best 6.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Apoptosis regulator Bcl-2 CHEMBL4860 | EC50 | 6.52 | 6.52 | 300.0 | 1 |
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | EC50 | 6.3 | 6.3 | 500.0 | 1 |
| Bcl-2-related protein A1 CHEMBL6044 | EC50 | 6.22 | 6.22 | 600.0 | 1 |
| Bcl-2-like protein 1 CHEMBL4625 | EC50 | 6.05 | 6.05 | 900.0 | 1 |
| Bcl-2-related protein A1 CHEMBL6044 | Ki | 6.0 | 6.0 | 1000.0 | 1 |
| Bcl2-associated agonist of cell death CHEMBL3817 | Ki | 6.0 | 6.0 | 1000.0 | 1 |
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | Ki | 6.0 | 5.85 | 1000.0 | 2 |
| Bcl-2-like protein 10 CHEMBL5988 | Ki | 6.0 | 6.0 | 1000.0 | 1 |
| Bcl-2-like protein 2 CHEMBL4677 | Ki | 6.0 | 5.575 | 1000.0 | 2 |
| Apoptosis regulator Bcl-2 CHEMBL4860 | Ki | 5.96 | 5.96 | 1110.0 | 1 |
| Apoptosis regulator Bcl-2 CHEMBL4860 | IC50 | 5.96 | 5.96 | 1110.0 | 2 |
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | IC50 | 5.54 | 5.54 | 2900.0 | 2 |
| Plasmodium falciparum CHEMBL364 | IC50 | 5.37 | 5.335 | 4250.0 | 2 |
| Bcl-2-like protein 1 CHEMBL4625 | Ki | 5.33 | 5.33 | 4690.0 | 1 |
| Bcl-2-like protein 1 CHEMBL4625 | IC50 | 5.33 | 5.33 | 4690.0 | 2 |
| Adenosine receptor A1 CHEMBL226 | Ki | 5.3 | 5.3 | 5000.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 4.92 | 4.92 | 12100.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 22.39 | uL.min-1.(10^6cells)-1 | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine