Compound Detail
CHEMBL112797
SGS-742 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL112797 |
| Name | SGS-742 |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | ONNMDRQRSGKZCN-UHFFFAOYSA-N |
3
Targets
6
Activities
1
Assay Types
0
PK Parameters
20
Publications
5
Known Names
1
Indications
1
Mechanisms
Molecular Properties
179.2
MW (Da)
1.41
ALogP
2
HBA
2
HBD
63.3
PSA (Ų)
0.61
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| GABA-B receptor antagonist | ANTAGONIST | GABA-B receptor | ✓ | ✓ |
Indications
Alzheimer Disease
Activity Summary
IC50 6 meas. best 4.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| GABA-B receptor CHEMBL2111463 | IC50 | 4.42 | 4.42 | 38000.0 | 1 |
| Gamma-aminobutyric acid type B receptor subunit 1 CHEMBL2753 | IC50 | 4.42 | 4.42 | 38000.0 | 1 |
| Gamma-aminobutyric acid receptor subunit rho-1 CHEMBL3561 | IC50 | 4.21 | 4.21 | 62000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gamma-aminobutyric acid type B receptor subunit 1 | IC50 | = | 38000.0 | nM | 4.42 | Inhibition of binding of [3H]CGP-27492 to gamma-aminobutyric acid type B recepto... | 7650685 |
| GABA-B receptor | IC50 | = | 38000.0 | nM | 4.42 | Antagonist activity at human recombinant GABAb 1b/2 receptor expressed in Xenopu... | 24900248 |
| Gamma-aminobutyric acid receptor subunit rho-1 | IC50 | = | 62000.0 | nM | 4.21 | Antagonist activity at human GABAc Rho1 receptor expressed in Xenopus oocytes as... | 18528996 |
| Gamma-aminobutyric acid receptor subunit rho-1 | IC50 | = | 62000.0 | nM | 4.21 | Antagonist activity at human recombinant GABAc rho-1 receptor expressed in Xenop... | 24900248 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C5MD00442J | Unchecked | 2 |
| 7650685 | 10.1021/jm00017a016 | GABA-A receptor; anion channel | 2 |
| 7650685 | 10.1021/jm00017a016 | Muscarinic acetylcholine receptor | 2 |
| 7650685 | 10.1021/jm00017a016 | Unchecked | 2 |
| 7650685 | 10.1021/jm00017a016 | Histamine H1 receptor | 1 |
| 24900248 | 10.1021/ml1001344 | GABA-A receptor; alpha-1/beta-2/gamma-2 | 1 |
| 18528996 | 10.1021/jm7015842 | Gamma-aminobutyric acid receptor subunit rho-1 | 1 |
| 7650685 | 10.1021/jm00017a016 | Substance-P receptor | 1 |
| 7650685 | 10.1021/jm00017a016 | Glutamate receptor ionotropic AMPA | 1 |
| 7650685 | 10.1021/jm00017a016 | Glutamate receptor ionotropic kainate | 1 |
| 7650685 | 10.1021/jm00017a016 | Glutamate [NMDA] receptor | 1 |
| 7650685 | 10.1021/jm00017a016 | Mu-type opioid receptor | 1 |
| 7650685 | 10.1021/jm00017a016 | Adenosine receptor A1 | 1 |
| 7650685 | 10.1021/jm00017a016 | Histamine H2 receptor | 1 |
| 7650685 | 10.1021/jm00017a016 | Gamma-aminobutyric acid type B receptor subunit 1 | 1 |
| 7650685 | 10.1021/jm00017a016 | Serotonin 3 (5-HT3) receptor | 1 |
| 7650685 | 10.1021/jm00017a016 | Serotonin 2 (5-HT2) receptor | 1 |
| 7650685 | 10.1021/jm00017a016 | Adrenergic receptor beta | 1 |
| 7650685 | 10.1021/jm00017a016 | Adrenergic receptor alpha-2 | 1 |
| 7650685 | 10.1021/jm00017a016 | Adrenergic receptor alpha-1 | 1 |
Data from ChEMBL 36 via Core Engine