Compound Detail
CHEMBL1503793
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Basic Information
| ChEMBL ID | CHEMBL1503793 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DMQCJSQWRZRAFU-RIYZIHGNSA-N |
8
Targets
8
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
418.4
MW (Da)
2.91
ALogP
7
HBA
3
HBD
120.1
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 6.01
EC50 3 meas. best 4.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 72 kDa type IV collagenase CHEMBL333 | IC50 | 6.01 | 6.01 | 968.0 | 1 |
| Cysteine protease ATG4B CHEMBL1741221 | IC50 | 4.96 | 4.96 | 11000.0 | 1 |
| 26S proteasome non-ATPase regulatory subunit 14 CHEMBL2007629 | IC50 | 4.84 | 4.84 | 14600.0 | 1 |
| Phospholipase A2 CHEMBL4426 | IC50 | 4.58 | 4.58 | 26600.0 | 1 |
| Intestinal-type alkaline phosphatase CHEMBL5573 | EC50 | 4.29 | 4.29 | 50800.0 | 1 |
| Alkaline phosphatase, tissue-nonspecific isozyme CHEMBL5979 | EC50 | 4.21 | 4.21 | 62200.0 | 1 |
| Alkaline phosphatase, germ cell type CHEMBL3402 | EC50 | 4.12 | 4.12 | 76800.0 | 1 |
| Prothrombin CHEMBL4471 | IC50 | 4.01 | 4.01 | 98500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine